Details of the Researcher

PHOTO

Belosludov Rodion Vladimirovich
Section
Institute for Materials Research
Job title
Associate Professor
Degree

  • 博士（工学）（東北大学）

Research History 5

  • 2011/10 - Present
    東北大学金属材料研究所　Associate Professor

  • 2007/04 - 2011/09
    東北大学金属材料研究所　Assistant Professor

  • 2005/04 - 2007/03
    東北大学金属材料研究所　助手

  • 2001/04 - 2005/03
    東北大学金属材料研究所　科学技術振興研究員

  • 1999/04 - 2001/03
    東北大学大学院工学研究科　リサーチアソシエイト

Education 3

  • Tohoku University　Graduate School, Division of Engineering

    - 1999/03

  • Institute of Inorganic Chemistry SB RAS　Graduate School, Division of Physics

    - 1994/07

  • Novosibirsk State University　Faculty of Science

    - 1991/06

Professional Memberships 6

  • APS

  • ACS

  • MRS

  • ナノ学会

  • 応用物理学会

  • 日本金属学会

︎Show all ︎Show first 5

Research Interests 1

  • ナノ材料 計算

Research Areas 1

  • Nanotechnology/Materials / Inorganic compounds/materials chemistry /

Awards 6

  1. ACS PUBLICATIONS AWARDS

    2021/03　American Chemical Society

  2. ACCMS Mid-Career Award

    2019/06　The 10th Conference of Asian Consortium for Computational Materials Science (ACCMS-10)　ACCMS Mid-Career Award for outstanding scientific achievement in computational materials science research and great contribution to the ACCMS community

  3. Best Poster Award

    2012/11/22　The 6th General Meeting of Asian Consortium on Computational Materials Science (ACCMS-VO)　Theoretical study of the collective vibration features in amorphous ices

  4. Best Poster Award

    2012/02/10　The 6th General Meeting of Asian Consortium on Computational Materials Science (ACCMS-VO)　THEORETICAL STUDY OF ATOMIC NANOWIRES DEPOSITED ON SILICON SURFACE

  5. Most Creative Idea at IPMM-2003

    2003/05/18　The 4th International Conference on Intelligent Processing and Manufacturing of Materials

  6. 金属材料研究所９３回講演会Young Scientist Award

    1996/11/29　金属材料研究所

Show all ︎Show 5

Papers 162

  1. Observation of Zeeman splitting in spin-polarized chiral fermion state in Weyl semimetal TaAs Peer-reviewed

    H. Murakawa, M. Komada, D.-A. Deaconu, M. S. Bahramy, R. V. Belosludov, T. Kida, M. Hagiwara, H. Sakai, N. Hanasaki

    Physical Review B　2025/06/06

    Publisher: American Physical Society (APS)

    DOI： 10.1103/qjt5-x6p4 　

    ISSN： 2469-9950

    eISSN： 2469-9969

  2. Nature of boson peak and associated heat capacity anomaly caused by structural and proton disorder in Ih and LDA Ices International-journal Peer-reviewed

    Rodion V. Belosludov, Kirill V. Gets, Ravil K. Zhdanov, Yulia Y. Bozhko, Vladimir R. Belosludov

    Scientific Reports　15　(1)　2025/04/30

    Publisher: Springer Science and Business Media LLC

    DOI： 10.1038/s41598-025-97595-y 　

    eISSN： 2045-2322

  3. Single Crystal Growth of Type-II Si Clathrate Containing Fully Occupied Na and Ba from a Na-Based Metal Complex Solution International-journal Peer-reviewed

    Haruhiko Morito, Yutaka IIjima, Masaya Fujioka, Rodion V. Belosludov, Masami Terauchi, Hisanori Yamane, Kozo Fujiwara

    Crystal Growth & Design　25　(7)　2120-2127　2025/03/11

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.cgd.5c00013 　

    ISSN： 1528-7483

    eISSN： 1528-7505

  4. Direct synthesis of a semiconductive double-helical phosphorus allotrope in a metal-organic framework Peer-reviewed

    Sergei A. Sapchenko, Rodion V. Belosludov, Inigo J. Vitoria-Irezabal, Ivan da Silva, Xi Chen, George F. S. Whitehead, John Maddock, Louise S. Natrajan, Meredydd Kippax-Jones, Dukula De Alwis Jayasinghe, Carlo Bawn, Daniil M. Polyukhov, Yinlin Chen, Vladimir P. Fedin, Sihai Yang, Martin Schröder

    Nature Communications　16　(1)　1578-1-1578-9　2025/02/12

    Publisher: Springer Science and Business Media LLC

    DOI： 10.1038/s41467-025-55999-4 　

    eISSN： 2041-1723

    More details Close

    Abstract There remains much ambiguity regarding the structure of red phosphorus. We report the adsorption and photo-polymerisation of P4 molecules encapsulated in an indium(III)-based metal-organic framework to afford a double-helical chain composite comprising of [P8] units. The similarity between the Raman spectrum of bulk red phosphorus and of the metal-organic framework – (P8)n adduct suggests the presence of such helical chains in the structure of amorphous red phosphorus. This provides crystallographic evidence of the structural building blocks of the red phosphorus allotrope stabilized within the pores of a metal-organic host. The (P8)n inclusion compound is an air-stable semiconductor with a band gap of 2.3 eV, which is relevant for gas detection and photo-catalysis. We demonstrate that this phosphorus adduct demonstrates a 10-fold increase in conversion in the oxidation of methyl orange dye compared with the parent metal-organic framework material.

  5. Band asymmetry–driven nonreciprocal electronic transport in a helimagnetic semimetal α-EuP 3 Peer-reviewed

    Alex Hiro Mayo, Darius-Alexandru Deaconu, Hidetoshi Masuda, Yoichi Nii, Hidefumi Takahashi, Rodion Vladimirovich Belosludov, Shintaro Ishiwata, Mohammad Saeed Bahramy, Yoshinori Onose

    Proceedings of the National Academy of Sciences　122　(4)　e2405839122-1-e2405839122-7　2025/01/23

    Publisher: Proceedings of the National Academy of Sciences

    DOI： 10.1073/pnas.2405839122 　

    ISSN： 0027-8424

    eISSN： 1091-6490

    More details Close

    Chiral magnetic textures give rise to unconventional magnetotransport phenomena such as the topological Hall effect and nonreciprocal electronic transport. While the correspondence between topology or symmetry of chiral magnetic structures and such transport phenomena has been well established, a microscopic understanding based on the spin-dependent band structure in momentum space remains elusive. Here, we demonstrate how a chiral magnetic superstructure introduces an asymmetry in the electronic band structure and triggers a nonreciprocal electronic transport in a centrosymmetric helimagnet α-EuP 3 . The magnetic structure of α-EuP 3 is highly tunable by a magnetic field and closely coupled to its semimetallic electronic band structure, enabling a systematic study across chiral and achiral magnetic phases on the correspondence between nonreciprocal transport and electronic band asymmetry. Our findings reveal how a microscopic change in the magnetic configuration of charge carriers can lead to nonreciprocal electronic transport, paving the way for designing chiral magnets with desirable properties.

  6. A Molecular Dynamics Study of the Influence of Low-Dosage Methanol on Hydrate Formation in Seawater and Pure Water Metastable Solutions of Methane Peer-reviewed

    Rodion V. Belosludov, Kirill V. Gets, Ravil K. Zhdanov, Yulia Y. Bozhko, Vladimir R. Belosludov

    Journal of Marine Science and Engineering　12　(9)　1626-1626　2024/09/12

    Publisher: MDPI AG

    DOI： 10.3390/jmse12091626 　

    eISSN： 2077-1312

    More details Close

    The behavior of low concentrations of methanol (0.5 and 1.0 wt% of water) as a promoter for hydrate formation in seawater or pure water metastable solutions of methane was investigated using the classical molecular dynamics method at moderate temperature and pressure. The influence of methanol on the dynamics of the re-arrangement of the hydrogen bond network in seawater and pure water solutions of methane was studied by calculating order parameters of the tetrahedral environment and intermolecular torsion angles for water molecules, as well as by calculating the number of hydrogen bonds, hydrate, and hydrate-like cavities. It was found that hydrate nucleation can be considered a collective process in which the rate of hydrate growth is faster in systems with low concentrations of methanol, and confident hydrate growth begins earlier in a metastable solution without sea salt with a small amount of methanol than in systems without methanol.

  7. Chemical Trends of the Bulk and Surface Termination-Dependent Electronic Structure of Metal-Intercalated Transition Metal Dichalcogenides Peer-reviewed

    Brendan Edwards, Darius-A. Deaconu, Philip A. E. Murgatroyd, Sebastian Buchberger, Tommaso Antonelli, Daniel Halliday, Gesa-R. Siemann, Andela Zivanovic, Liam Trzaska, Akhil Rajan, Edgar Abarca Morales, Daniel A. Mayoh, Amelia E. Hall, Rodion V. Belosludov, Matthew D. Watson, Timur K. Kim, Deepnarayan Biswas, Tien-Lin Lee, Craig M. Polley, Dina Carbone, Mats Leandersson, Geetha Balakrishnan, Mohammad Saeed Bahramy, Phil D. C. King

    Chemistry of Materials　2024/07/23

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.chemmater.4c00824 　

    ISSN： 0897-4756

    eISSN： 1520-5002

  8. Room-temperature Pressure-induced Phase Separation in Glassy Alloys Peer-reviewed

    D.V. Louzguine-Luzgin, R.V. Belosludov, M.I. Ojovan

    Materials Today Communications　40　109453-109453　2024/06

    Publisher: Elsevier BV

    DOI： 10.1016/j.mtcomm.2024.109453 　

    ISSN： 2352-4928

  9. Magnetically Controllable Two‐Dimensional Spin Transport in a 3D Crystal Peer-reviewed

    Oliver Dowinton, Denis Maryenko, Rodion Vladimirovich Belosludov, Bohm‐Jung Yang, Mohammad Saeed Bahramy

    Advanced Functional Materials　33　(43)　2300995-1-2300995-11　2023/10/18

    Publisher: Wiley

    DOI： 10.1002/adfm.202300995 　

    ISSN： 1616-301X

    eISSN： 1616-3028

    More details Close

    Abstract 2D phases of matter have become a new paradigm in condensed matter physics, bringing in an abundance of novel quantum phenomena with promising device applications. However, realizing such quantum phases has its own challenges, stimulating research into non‐traditional methods to create them. One such attempt is presented here, where the intrinsic crystal anisotropy in a “fractional” perovskite, EuxTaO3 (x = 1/3 − 1/2), leads to the formation of stacked layers of quasi‐2D electron gases, despite being a 3D bulk system. These carriers possess topologically non‐trivial spin textures, indirectly controlled by an external magnetic field via proximity effect, making it an ideal system for spintronics, for which several possible applications are proposed. An anomalous Hall effect with a non‐monotonic dependence on carrier density is shown to exist, signifying a shift in band topology with carrier doping. Furthermore, quantum oscillations in charge conductivity and oscillating thermoelectric properties are examined and proposed as routes to experimentally demonstrate the quasi‐2D behavior.

  10. Valley-dimensionality locking of superconductivity in cubic phosphides International-journal International-coauthorship Peer-reviewed

    Lingyi Ao, Junwei Huang, Feng Qin, Zeya Li, Toshiya Ideue, Keivan Akhtari, Peng Chen, Xiangyu Bi, Caiyu Qiu, Dajian Huang, Long Chen, Rodion V. Belosludov, Huiyang Gou, Wencai Ren, Tsutomu Nojima, Yoshihiro Iwasa, Mohammad Saeed Bahramy, Hongtao Yuan

    Science Advances　9　(36)　eadf6758-1-eadf6758-10　2023/09/08

    Publisher: American Association for the Advancement of Science (AAAS)

    DOI： 10.1126/sciadv.adf6758 　

    eISSN： 2375-2548

    More details Close

    Two-dimensional superconductivity is primarily realized in atomically thin layers through extreme exfoliation, epitaxial growth, or interfacial gating. Apart from their technical challenges, these approaches lack sufficient control over the Fermiology of superconducting systems. Here, we offer a Fermiology-engineering approach, allowing us to desirably tune the coherence length of Cooper pairs and the dimensionality of superconducting states in arsenic phosphides As x P 1− x under hydrostatic pressure. We demonstrate how this turns these compounds into tunable two-dimensional superconductors with a dome-shaped phase diagram even in the bulk limit. This peculiar behavior is shown to result from an unconventional valley-dimensionality locking mechanism, driven by a delicate competition between three-dimensional hole-type and two-dimensional electron-type energy pockets spatially separated in momentum space. The resulting dimensionality crossover is further discussed to be systematically controllable by pressure and stoichiometry tuning. Our findings pave a unique way to realize and control superconducting phases with special pairing and dimensional orders.

  11. Computational Discovery of Active and Selective Metal‐Nitrogen‐Graphene Catalysts for Electrooxidation of Water to H2O2 Peer-reviewed

    Payal Chaudhary, Iman Evazzade, Rodion Belosludov, Vitaly Alexandrov

    ChemCatChem　15　(10)　202300591-1-202300591-8　2023/04/12

    Publisher: Wiley

    DOI： 10.1002/cctc.202300055 　

    ISSN： 1867-3880

    eISSN： 1867-3899

    More details Close

    Abstract A direct electrosynthesis of H2O2 from either O2 or H2O is an attractive strategy to replace the energy‐intensive industrial anthraquinone process. Two‐electron water oxidation reaction (2e‐WOR) offers several advantages over the oxygen reduction reaction such as better mass transfer due to the absence of gas‐phase reactants. However, 2e‐WOR is a more challenging and less studied process with only a handful of metal oxides exhibiting reasonable activity/selectivity properties. Herein, we employ density‐functional‐theory calculations to screen a variety of metal‐nitrogen‐graphene structures for 2e‐WOR. As a consequence of scaling between the adsorption energies of reaction intermediates, we determine a linear relation between selectivities for the first and second reaction steps of 2e‐WOR, viz. that if selectivity toward adsorbed OH is improved, then selectivity toward H2O2 at the subsequent step is decreased. We also find that selectivity and activity are linearly scaled in such a way that a higher activity (i. e., a lower overpotential) leads to a lower selectivity for the H2O2 formation step. Based on the obtained results several chemistries, e. g., containing NiNx−C moieties, are predicted to rival the best‐performing metal oxides such as ZnO and CaSnO3 in terms of combination of their activity/selectivity characteristics for 2e‐WOR.

  12. Molecular Dynamics Study of Clathrate-like Ordering of Water in Supersaturated Methane Solution at Low Pressure Peer-reviewed

    Rodion V. Belosludov, Kirill V. Gets, Ravil K. Zhdanov, Yulia Y. Bozhko, Vladimir R. Belosludov, Li-Jen Chen, Yoshiyuki Kawazoe

    Molecules　28　(7)　2960-2960　2023/03/26

    Publisher: MDPI AG

    DOI： 10.3390/molecules28072960 　

    eISSN： 1420-3049

    More details Close

    Using molecular dynamics, the evolution of a metastable solution for “methane + water” was studied for concentrations of 3.36, 6.5, 9.45, 12.2, and 14.8 mol% methane at 270 K and 1 bar during 100 ns. We have found the intriguing behavior of the system containing over 10,000 water molecules: the formation of hydrate-like structures is observed at 6.5 and 9.45 mol% concentrations throughout the entire solution volume. This formation of “blobs” and the following amorphous hydrate were studied. The creation of a metastable methane solution through supersaturation is the key to triggering the collective process of hydrate formation under low pressure. Even the first stage (0–1 ns), before the first fluctuating cavities appear, is a collective process of H-bond network reorganization. The formation of fluctuation cavities appears before steady hydrate growth begins and is associated with a preceding uniform increase in the water molecule’s tetrahedrality. Later, the constantly presented hydrate cavities become the foundation for a few independent hydrate nucleation centers, this evolution is consistent with the labile cluster and local structure hypotheses. This new mechanism of hydrogen-bond network reorganization depends on the entropy of the cavity arrangement of the guest molecules in the hydrate lattice and leads to hydrate growth.

  13. Giant valley-Zeeman coupling in the surface layer of an intercalated transition metal dichalcogenide Peer-reviewed

    B. Edwards, O. Dowinton, A. E. Hall, P. A. E. Murgatroyd, S. Buchberger, T. Antonelli, G.-R. Siemann, A. Rajan, E. Abarca Morales, A. Zivanovic, C. Bigi, R. V. Belosludov, C. M. Polley, D. Carbone, D. A. Mayoh, G. Balakrishnan, M. S. Bahramy, P. D. C. King

    Nature Materials　22　(4)　459-465　2023/01/19

    Publisher: Springer Science and Business Media LLC

    DOI： 10.1038/s41563-022-01459-z 　

    ISSN： 1476-1122

    eISSN： 1476-4660

  14. Synthesis of Nanocrystalline Yttrium Oxide and Evolution of Morphology and Microstructure during Thermal Decomposition of Y2(C2O4)3·10H2O Peer-reviewed

    Pavel A. Gribov, Anatoly A. Sidelnikov, Rodion V. Belosludov, Alexander A. Matvienko

    Ceramics　6　(1)　16-29　2023/01/06

    Publisher: MDPI AG

    DOI： 10.3390/ceramics6010002 　

    eISSN： 2571-6131

    More details Close

    A study of the morphology and evolution of the microstructure during thermal decomposition of Y2(C2O4)3·10H2O was conducted, and the stages and factors having the greatest impact on particle size and specific surface area were identified. The effect of the yttrium oxalate hexahydrate phases on the course of decomposition was also investigated. The evolution of the morphology and microstructure of decomposition products was explained from the analysis of volume shrinkage at various stages of the reaction. The formation of oxycarbonate is accompanied by the largest shrinkage during the reaction. At this stage, there is a significant increase in the specific surface area to 60–90 m2/g. Conversely, the morphology and microstructure of the particles during the transformation of oxycarbonate into yttrium oxide change insignificantly. Yttrium oxide powders obtained from the monoclinic and triclinic hexahydrate phases have the same specific surface area, but different morphology and bulk density due to pseudomorph formation. The carbon formed during thermolysis was shown to affect the specific surface area of the decomposition product. Two methods for producing yttrium oxide with high specific surface area have been proposed, and nanocrystalline yttrium oxide with a specific surface area of 65 m2/g was obtained.

  15. Axial-Bonding-Driven Dimensionality Effect on the Charge-Density Wave in NbSe2 Peer-reviewed

    Dongjing Lin, Ahmad Ranjbar, Xiaoxia Li, Xinyu Huang, Yuan Huang, Helmuth Berger, László Forró, Kenji Watanabe, Takashi Taniguchi, Rodion V. Belosludov, Thomas D. Kühne, Haifeng Ding, Mohammad Saeed Bahramy, Xiaoxiang Xi

    Nano Letters　22　(23)　9389-9395　2022/12/14

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.nanolett.2c03280 　

    ISSN： 1530-6984

    eISSN： 1530-6992

  16. Ultrafine nanoporous intermetallic catalysts by high-temperature liquid metal dealloying for electrochemical hydrogen production International-journal International-coauthorship Peer-reviewed

    Ruirui Song, Jiuhui Han, Masayuki Okugawa, Rodion Belosludov, Takeshi Wada, Jing Jiang, Daixiu Wei, Akira Kudo, Yuan Tian, Mingwei Chen, Hidemi Kato

    Nature Communications　13　(5157)　1-12　2022/09/02

    Publisher: Springer Science and Business Media LLC

    DOI： 10.1038/s41467-022-32768-1 　

    eISSN： 2041-1723

  17. Electronic Structures of Group III–V Element Haeckelite Compounds: A Novel Family of Semiconductors, Dirac Semimetals, and Topological Insulators International-journal International-coauthorship Peer-reviewed

    Mohammad Khazaei, Ahmad Ranjbar, Yoon‐Gu Kang, Yunye Liang, Rasoul Khaledialidusti, Soungmin Bae, Hannes Raebiger, Vei Wang, Myung Joon Han, Hiroshi Mizoguchi, Mohammad S. Bahramy, Thomas D. Kühne, Rodion V. Belosludov, Kaoru Ohno, Hideo Hosono

    Advanced Functional Materials　32　(20)　2110930-2110930　2022/02/18

    Publisher: Wiley

    DOI： 10.1002/adfm.202110930 　

    ISSN： 1616-301X

    eISSN： 1616-3028

  18. Second-harmonic generation in atomically thin 1T−TiSe2 and its possible origin from charge density wave transitions International-journal International-coauthorship Peer-reviewed

    Ruiming Zhang, Wei Ruan, Junyao Yu, Libo Gao, Helmuth Berger, László Forró, Kenji Watanabe, Takashi Taniguchi, Ahmad Ranjbar, Rodion V. Belosludov, Thomas D. Kühne, Mohammad Saeed Bahramy, Xiaoxiang Xi

    Physical Review B　105　(8)　085409-085409　2022/02/08

    Publisher: American Physical Society (APS)

    DOI： 10.1103/physrevb.105.085409 　

    ISSN： 2469-9950

    eISSN： 2469-9969

  19. Collective Effect of Transformation of a Hydrogen Bond Network at the Initial State of Growth of Methane Hydrate International-journal International-coauthorship Peer-reviewed

    V. R. Belosludov, K. V. Gets, R. K. Zhdanov, Yu. Yu. Bozhko, R. V. Belosludov, L.-J. Chen

    JETP Letters　115　(3)　124-129　2022/02

    Publisher: Pleiades Publishing Ltd

    DOI： 10.1134/s0021364022030031 　

    ISSN： 0021-3640

    eISSN： 1090-6487

  20. Clusters of Cesium–Lead–Iodide Perovskites in the Zeolite Matrix International-journal International-coauthorship Peer-reviewed

    Igor Dmitruk, Yelyzaveta Vikhrova, Andriy Dmytruk, Nataliya Berezovska, Yuri Barnakov, Polina Vartik, Rodion V. Belosludov

    ACS Omega　6　(42)　27711-27715　2021/10/12

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acsomega.1c02864 　

    ISSN： 2470-1343

    eISSN： 2470-1343

  21. A theoretical investigation of topological phase modulation in carbide MXenes: Role of image potential states International-journal International-coauthorship Peer-reviewed

    Mengying Wang, Ahmad Ranjbar, Thomas D. Kühne, Rodion V. Belosludov, Yoshiyuki Kawazoe, Yunye Liang

    Carbon　181　370-378　2021/08

    Publisher: Elsevier BV

    DOI： 10.1016/j.carbon.2021.05.026 　

    ISSN： 0008-6223

  22. Accurate Prediction of the Excited States in the Fully Conjugated Porphyrin Tapes across the Full Spectral Range: A Story of the Interplay between π–π* and Intramolecular Charge-Transfer Transitions in Soft Chromophores International-journal Peer-reviewed

    Rodion V. Belosludov, Dustin E. Nevonen, Victor N. Nemykin

    The Journal of Physical Chemistry A　125　(12)　2480-2491　2021/03/18

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.jpca.1c00217 　

    ISSN： 1089-5639

    eISSN： 1520-5215

  23. Effect of the synthesis conditions of Ce0.9Gd0.1O1.95 powder on its morphology and characteristics of the oxygen ion-conducting ceramics obtained by spark plasma sintering International-journal International-coauthorship Peer-reviewed

    D.V. Maslennikov, A.A. Matvienko, A.A. Sidelnikov, D.V. Dudina, M.A. Esikov, R.V. Belosludov, H. Kato

    Ceramics International　47　(2)　2557-2564　2021/01

    Publisher: Elsevier BV

    DOI： 10.1016/j.ceramint.2020.09.101 　

    ISSN： 0272-8842

  24. The nano-structural inhomogeneity of dynamic hydrogen bond network of TIP4P/2005 water International-journal International-coauthorship

    Vladimir Belosludov, Kirill Gets, Ravil Zhdanov, Valery Malinovsky, Yulia Bozhko, Rodion Belosludov, Nikolay Surovtsev, Oleg Subbotin, Yoshiyuki Kawazoe

    Scientific Reports　10　(1)　106795-1-106795-13　2020/12

    Publisher: Springer Science and Business Media LLC

    DOI： 10.1038/s41598-020-64210-1 　

    eISSN： 2045-2322

  25. Lattice Dynamics Study of the Thermal Expansion of C3H8-, CH4-, CF4-, CO2-, Xe-, and N2-Hydrates International-journal International-coauthorship Peer-reviewed

    Rodion V. Belosludov, Ravil K. Zhdanov, Yulia Y. Bozhko, Kirill V. Gets, Oleg S. Subbotin, Yoshiyuki Kawazoe, Vladimir R. Belosludov

    Energy & Fuels　34　(10)　12771-12778　2020/10/15

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.energyfuels.0c01872 　

    ISSN： 0887-0624

    eISSN： 1520-5029

  26. Physical Properties and Characterization of the Binary Clathrate Hydrate with Methane + 1,1,1,3,3-Pentafluoropropane (HFC-245fa) + Water International-journal International-coauthorship

    Masamichi Kodera, Tomoyuki Matsueda, Rodion V. Belosludov, Ravil K. Zhdanov, Vladimir R. Belosludov, Satoshi Takeya, Saman Alavi, Ryo Ohmura

    The Journal of Physical Chemistry C　124　(38)　20736-20745　2020/09/24

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.jpcc.0c05565 　

    ISSN： 1932-7447

    eISSN： 1932-7455

  27. Role of Methane as a Second Guest Component in Thermodynamic Stability and Isomer Selectivity of Butane Clathrate Hydrates Peer-reviewed

    Rodion V. Belosludov, Ravil K. Zhdanov, Kirill V. Gets, Yulia Yu. Bozhko, Vladimir R. Belosludov, Y. Kawazoe

    The Journal of Physical Chemistry C　124　(34)　18474-18481　2020/08/27

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.jpcc.0c05947 　

    ISSN： 1932-7447

    eISSN： 1932-7455

  28. An atomistic study of the structural changes in a Zr-Cu-Ni-Al glass-forming liquid on vitrification monitored in-situ by X-ray diffraction and molecular dynamics simulation International-journal Peer-reviewed

    D. V. Louzguine-Luzgin, K. Georgarakis, J. Andrieux, L. Hennet, T. Morishita, K. Nishio and R. Belosludov

    Intermetallics　122　106795-1-106795-8　2020/07

    DOI： 10.1016/j.intermet.2020.106795 　

    ISSN： 0966-9795

  29. Experimental and Computational Studies of the Structure of CdSe Magic-Size Clusters International-journal Peer-reviewed

    Igor Dmitruk, Rodion V. Belosludov, Andriy Dmytruk, Yasuto Noda, Yuri Barnakov, Yeon-Su Park, Atsuo Kasuya

    The Journal of Physical Chemistry A　124　(17)　3398-3406　2020/04/30

    Publisher: American Chemical Society (ACS)

    DOI： 10.1021/acs.jpca.0c00782 　

    ISSN： 1089-5639

    eISSN： 1520-5215

  30. Synthesis and electrical conductivity of Na<inf>3</inf>B<inf>20</inf> International-journal Peer-reviewed

    Haruhiko Morito, Syouta Shibano, Takahiro Yamada, Takuji Ikeda, Masami Terauchi, Rodion V. Belosludov, Hisanori Yamane

    Solid State Sciences　102　106166-1-106166-5　2020/04

    DOI： 10.1016/j.solidstatesciences.2020.106166 　

    ISSN： 1293-2558

  31. Transformation of hydrogen bond network during CO2 clathrate hydrate dissociation International-journal International-coauthorship

    Kirill Gets, Vladimir Belosludov, Ravil Zhdanov, Yulia Bozhko, Rodion Belosludov, Oleg Subbotin, Nikita Marasanov, Yoshiyuki Kawazoe

    Applied Surface Science　499　143644-143644　2020/01

    Publisher: Elsevier BV

    DOI： 10.1016/j.apsusc.2019.143644 　

    ISSN： 0169-4332

  32. The atomic structure of a bulk metallic glass resolved by scanning tunneling microscopy and ab-initio molecular dynamics simulation Peer-reviewed

    R. V. Belosludov, A. I. Oreshkin, S. I. Oreshkin, D. A. Muzychenko, H. Kato, D. V. Louzguine-Luzgin

    Journal of Alloys and Compounds　816　152680-1-152680-5　2019/10

    DOI： 10.1016/j.jallcom.2019.152680 　

    ISSN： 0925-8388

  33. Phase diagram and composition of water based crystalline phases in hydrogen Water binary system Peer-reviewed

    R. K.Zhdanov, Yu. Y. Bozhko, V. R. Belosludov, O. S. Subbotin, K. V. Gets, R. V. Belosludov, Y. Kawazoe

    Solid State Communication　294　6-10　2019/06

    DOI： 10.1016/j.ssc.2019.03.002 　

  34. Understanding hysteresis in carbon dioxide sorption in porous metal-organic frameworks. Peer-reviewed

    S. A. Sapchenko, M. O. Barsukova, R. V. Belosludov, K. A. Kovalenko, D. G. Samsonenko, A. S. Poryvaev, A. M. Sheveleva, M. V. Fedin, A. S. Bogomyakov, D. N. Dybtsev, M. Schröder, V. M. Fedin

    Inorganic Chemistry　58　(10)　6811-6820　2019/05

    DOI： 10.1021/acs.inorgchem.9b00016 　

  35. 1,7Dipyrene-containing aza-BODIPYs: Are pyrene groups effective as ligands to promote and direct complex formation with common nanocarbon materials? Peer-reviewed

    Y. V, Zatsikha,T, S. Blesener, P. C. Goff, A. Healy, R. Swedin, D. E. Herbert, G. T. Rohde, K. Chanawanno, C. J. Ziegler, R. V. Belosludov, D. A. Blank, V. N. Nemykin

    J. Phys. Chem. C　122　(49)　27893-27916　2018/12/13

    DOI： 10.1021/acs.jpcc.8b09504 　

  36. Clathrate hydrates for energy storage and transportation

    V. R. Belosludov, Yu Yu Bozhko, K. V. Gets, O. S. Subbotin, Y. Kawazoe

    Journal of Physics: Conference Series　1128　(1)　2018/12/07

    Publisher: Institute of Physics Publishing

    DOI： 10.1088/1742-6596/1128/1/012031 　

    ISSN： 1742-6596 1742-6588

  37. Thermodynamic Description of Crystalline Water Phases Containing Hydrogen Peer-reviewed

    R. K. Zhdanov, V. R. Belosludov, Yu. Yu. Bozhko, O. S. Subbotin, K. V. Gets, R. V. Belosludov

    JETP LETTERS　108　(12)　806-809　2018/12

    DOI： 10.1134/S0021364018240128 　

  38. Simultaneous Prediction of the Energies of Qx and Qy Bands and Intramolecular Charge-Transfer Transitions in Benzoannulated and Non-Peripherally Substituted Metal-Free Phthalocyanines and Their Analogues: No Standard TDDFT Silver Bullet Yet Peer-reviewed

    R. V. Belosludov, D. Nevonen, H. M. Rhoda, J. R. sabin, V. N. Nemykin

    J. Phys. Chem. A　123　(1)　132-152　2018/12

    DOI： 10.1021/acs.jpca.8b07647 　

  39. Influence of N2 on Formation Conditions and Guest Distribution of Mixed CO2 + CH4 Gas Hydrates Peer-reviewed

    V. R. Belosludov, Yu. Yu. Bozhko, O. S. Subbotin, R. V. Belosludov, R. K. Zhdanov, K. Gets, Y. Kawazoe

    Molecules　23　(12)　Art.No. 3336　2018/12

    DOI： 10.3390/molecules23123336 　

  40. Ozone storage capacity in clathrate hydrates formed by O3 + O2 + N2 + CO2 gas mixtures Peer-reviewed

    Oleg S. Subbotin, Yulia Yu. Bozhko, Ravil K. Zhdanov, Kirill V. Gets, Vladimir R. Belosludov, Rodion V. Belosludov, Yoshiyuki Kawazoe

    Physical Chemistry Chemical Physics　20　(18)　12637-12641　2018

    Publisher: Royal Society of Chemistry

    DOI： 10.1039/c8cp01595c 　

    ISSN： 1463-9076

  41. Polarons in endohedral Li+@C-60(-) dimers and in 1D and 2D crystals Peer-reviewed

    Yoshiyuki Kawazoe, Vladimir R. Belosludov, Ravil K. Zhdanov, Rodion V. Belosludov

    SOLID STATE COMMUNICATIONS　265　1-5　2017/10

    DOI： 10.1016/j.ssc.2017.07.017 　

    ISSN： 0038-1098

    eISSN： 1879-2766

  42. Modeling the polymorphic transformations in amorphous solid ice Peer-reviewed

    Rodion V. Belosludov, Kirill V. Gets, Oleg S. Subbotin, Ravil K. Zhdanov, Yulia Yu. Bozhko, Vladimir R. Belosludov, Jun-ichi Kudoh

    JOURNAL OF ALLOYS AND COMPOUNDS　707　108-113　2017/06

    DOI： 10.1016/j.jallcom.2016.12.197 　

    ISSN： 0925-8388

    eISSN： 1873-4669

  43. Magnetic Circular Dichroism of Transition-Metal Complexes of Perfluorophenyl-N-Confused Porphyrins: Inverting Electronic Structure through a Proton Peer-reviewed

    Samantha Doble, Allen J. Osinski, Shelby M. Holland, Julia M. Fisher, G. Richard Geier, Rodion V. Belosludov, Christopher J. Ziegler, Victor N. Nemykin

    JOURNAL OF PHYSICAL CHEMISTRY A　121　(19)　3689-3698　2017/05

    DOI： 10.1021/acs.jpca.7b02908 　

    ISSN： 1089-5639

  44. Theoretical modeling of the thermodynamic properties and the phase diagram of binary gas hydrates of argon and hydrogen Peer-reviewed

    Ravil K. Zhdanov, Kirill V. Gets, Rodion V. Belosludov, Oleg S. Subbotin, Yulia Y. Bozhko, Vladimir R. Belosludov

    FLUID PHASE EQUILIBRIA　434　87-92　2017/02

    DOI： 10.1016/j.fluid.2016.11.030 　

    ISSN： 0378-3812

    eISSN： 1879-0224

  45. ZnO nested shell magic clusters as tetrapod nuclei Peer-reviewed

    Andriy Dmytruk, Igor Dmitruk, Yevhen Shynkarenko, Rodion Belosludov, Atsuo Kasuya

    RSC ADVANCES　7　(35)　21933-21942　2017

    DOI： 10.1039/c7ra01610g 　

    ISSN： 2046-2069

  46. Many-electron states of the N-2 and N-3 color centers in diamond: A firstprinciples and many-body study Peer-reviewed

    Mohsen Babamoradi, Sussan Asgari, Ahmad Ranjbar, Rodion V. Belosludov, Seiji Yunoki

    PHYSICA B-CONDENSED MATTER　505　17-21　2017/01

    DOI： 10.1016/j.physb.2016.10.021 　

    ISSN： 0921-4526

    eISSN： 1873-2135

  47. Tuning Up an Electronic Structure of the Subphthalocyanine Derivatives toward Electron-Transfer Process in Noncovalent Complexes with C-60 and C-70 Fullerenes: Experimental and Theoretical Studies Peer-reviewed

    Hannah M. Rhoda, Mathew P. Kayser, Yefeng Wang, Alexander Y. Nazarenko, Rodion V. Belosludov, Paul Kiprof, David A. Blank, Victor N. Nemykin

    INORGANIC CHEMISTRY　55　(19)　9549-9563　2016/10

    DOI： 10.1021/acs.inorgchem.6b00992 　

    ISSN： 0020-1669

    eISSN： 1520-510X

  48. Conceptual design of tetraazaporphyrin- and subtetraazaporphyrin-based functional nanocarbon materials: electronic structures, topologies, optical properties, and methane storage capacities Peer-reviewed

    Rodion V. Belosludov, Hannah M. Rhoda, Ravil K. Zhdanov, Vladimir R. Belosludov, Yoshiyuki Kawazoe, Victor N. Nemykin

    PHYSICAL CHEMISTRY CHEMICAL PHYSICS　18　(19)　13503-13518　2016/05

    DOI： 10.1039/c5cp07552a 　

    ISSN： 1463-9076

    eISSN： 1463-9084

  49. Hydrogen hydrates: Equation of state and self-preservation effect Peer-reviewed

    Rodion V. Belosludov, Yulia Yu. Bozhko, Ravil K. Zhdanov, Oleg S. Subbotin, Yoshiyuki Kawazoe, Vladimir R. Belosludov

    FLUID PHASE EQUILIBRIA　413　220-228　2016/04

    DOI： 10.1016/j.fluid.2015.11.031 　

    ISSN： 0378-3812

    eISSN： 1879-0224

  50. Initial Report on Molecular and Electronic Structure of Spherical Multiferrocenyl/tin(IV) (Hydr)oxide [(FcSn)(12)O-14(OH)(6)]X-2 Clusters Peer-reviewed

    Pavlo V. Solntsev, Derrick R. Anderson, Hannah M. Rhoda, Rodion V. Belosludov, Mahtab Fathi-Rasekh, Eranda Maligaspe, Nikolay N. Gerasimchuk, Victor N. Nemykin

    CRYSTAL GROWTH & DESIGN　16　(2)　1027-1037　2016/02

    DOI： 10.1021/acs.cgd.5b01568 　

    ISSN： 1528-7483

    eISSN： 1528-7505

  51. Probing Electronic Communications in Heterotrinuclear Fe-Ru-Fe Molecular Wires Formed by Ruthenium(II) Tetraphenylporphyrin and Isocyanoferrocene or 1,1 '-Diisocyanoferrocene Ligands Peer-reviewed

    Victor N. Nemykin, Semyon V. Dudkin, Mahtab Fathi-Rasekh, Andrew D. Spaeth, Hannah M. Rhoda, Rodion V. Belosludov, Mikhail V. Barybin

    INORGANIC CHEMISTRY　54　(22)　10711-10724　2015/11

    DOI： 10.1021/acs.inorgchem.5b01614 　

    ISSN： 0020-1669

    eISSN： 1520-510X

  52. Solvation Mechanism of Task-Specific Ionic Liquids in Water: A Combined Investigation Using Classical Molecular Dynamics and Density Functional Theory Peer-reviewed

    Surya V. J. Yuvaraj, Ravil K. Zhdanov, Rodion V. Belosludov, Vladimir R. Belosludov, Oleg S. Subbotin, Kiyoshi Kanie, Kenji Funaki, Atsushi Muramatsu, Takashi Nakamura, Yoshiyuki Kawazoe

    JOURNAL OF PHYSICAL CHEMISTRY B　119　(40)　12894-12904　2015/10

    DOI： 10.1021/acs.jpcb.5b05945 　

    ISSN： 1520-6106

    eISSN： 1520-5207

  53. Selective gas adsorption in microporous metal-organic frameworks incorporating urotropine basic sites: an experimental and theoretical study Peer-reviewed

    S. A. Sapchenko, D. N. Dybtsev, D. G. Samsonenko, R. V. Belosludov, V. R. Belosludov, Y. Kawazoe, M. Schroeder, V. P. Fedin

    CHEMICAL COMMUNICATIONS　51　(73)　13918-13921　2015

    DOI： 10.1039/c5cc05779e 　

    ISSN： 1359-7345

    eISSN： 1364-548X

  54. Theoretical evaluation on solubility of synthesized task specific ionic liquids in water Peer-reviewed

    Surya V. J. Yuvaraj, Oleg S. Subbotin, Rodion V. Belosludov, Vladimir R. Belosludov, Kiyoshi Kanie, Kenji Funaki, Atsushi Muramatsu, Takashi Nakamura, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    JOURNAL OF MOLECULAR LIQUIDS　200　232-237　2014/12

    DOI： 10.1016/j.molliq.2014.10.028 　

    ISSN： 0167-7322

    eISSN： 1873-3166

  55. Theoretical study of hydrogen storage in binary hydrogen-methane clathrate hydrates Peer-reviewed

    R. V. Belosludov, R. K. Zhdanov, O. S. Subbotin, H. Mizuseki, Y. Kawazoe, V. R. Belosludov

    JOURNAL OF RENEWABLE AND SUSTAINABLE ENERGY　6　(5)　053132-1-053132-20　2014/09

    DOI： 10.1063/1.4899075 　

    ISSN： 1941-7012

  56. Scanning tunneling microscopy study of morphology and electronic properties in (K0.7Na0.3)Fe2-ySe2 single crystal Peer-reviewed

    A. S. Trifonov, Y. A. Ovchenkov, D. E. Presnov, R. Belosludov, A. I. Boltalin, M. Liu, I. V. Morozov, H. Nejo, A. N. Vasiliev

    JOURNAL OF APPLIED PHYSICS　116　(4)　043904-1-043904-4　2014/07

    DOI： 10.1063/1.4891227 　

    ISSN： 0021-8979

    eISSN： 1089-7550

  57. Stability and Composition of Helium Hydrates Based on Ices I-h and II at Low Temperatures Peer-reviewed

    Rodion V. Belosludov, Yulia Y. Bozhko, Oleg S. Subbotin, Vladimir R. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Vasily M. Fomin

    JOURNAL OF PHYSICAL CHEMISTRY C　118　(5)　2587-2593　2014/02

    DOI： 10.1021/jp411241s 　

    ISSN： 1932-7447

  58. Theoretical investigation of structures and compositions of double neon-methane clathrate hydrates, depending on gas phase composition and pressure

    Yu.Yu. Bozhko, O. S. Subbotin, V. M. Fomin, V. R. Belosludov, Y. Kawazoe

    Journal of Engineering Thermophysics　23　(1)　9-19　2014/01

    DOI： 10.1134/S1810232814010020 　

    ISSN： 1810-2328 1990-5432

  59. Self-Accelerating CO Sorption in a Soft Nanoporous Crystal Peer-reviewed

    Hiroshi Sato, Wataru Kosaka, Ryotaro Matsuda, Akihiro Hori, Yuh Hijikata, Rodion V. Belosludov, Shigeyoshi Sakaki, Masaki Takata, Susumu Kitagawa

    SCIENCE　343　(6167)　167-170　2014/01

    DOI： 10.1126/science.1246423 　

    ISSN： 0036-8075

    eISSN： 1095-9203

  60. Theoretical investigation of ozone hydrate formation conditions Peer-reviewed

    O. S. Subbotin, T. P. Adamova, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, V. R. Belosludov

    JOURNAL OF STRUCTURAL CHEMISTRY　53　(4)　627-633　2012/07

    DOI： 10.1134/S0022476612040026 　

    ISSN： 0022-4766

    eISSN： 1573-8779

  61. An atomistic level description of guest molecule effect on the formation of hydrate crystal nuclei by ab initio calculations Peer-reviewed

    R. V. Belosludov, H. Mizuseki, M. Souissi, Y. Kawazoe, J. Kudoh, O. S. Subbotin, T. P. Adamova, V. R. Belosludov

    JOURNAL OF STRUCTURAL CHEMISTRY　53　(4)　619-626　2012/07

    DOI： 10.1134/S0022476612040014 　

    ISSN： 0022-4766

  62. Experimental Study and Atomic Level Description of Adsorption Process of CO2 on Doped Alkaline Earth Oxides Peer-reviewed

    Kohei Sasaki, Koji Wakuta, Natsuki Tokuda, Rodion V. Belosludov, Shigeru Ueda, Ryo Inoue, Yoshiyuki Kawazoe, Tatsuro Ariyama

    ISIJ INTERNATIONAL　52　(7)　1233-1240　2012

    DOI： 10.2355/isijinternational.52.1233 　

    ISSN： 0915-1559

  63. Theoretical modelling of the phase diagrams of clathrate hydrates for hydrogen storage applications Peer-reviewed

    R. V. Belosludov, R. K. Zhdanov, O. S. Subbotin, H. Mizuseki, M. Souissi, Y. Kawazoe, V. R. Belosludov

    MOLECULAR SIMULATION　38　(10)　773-780　2012

    DOI： 10.1080/08927022.2011.654204 　

    ISSN： 0892-7022

  64. Effects of Alkali Adatoms on CO and H2S Adsorptions on the Fe(100) Surface: A Density Functional Theory Study Peer-reviewed

    M. Haris Mahyuddin, Rodion V. Belosludov, Mohammad Khazaei, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    JOURNAL OF PHYSICAL CHEMISTRY C　115　(48)　23893-23901　2011/12

    DOI： 10.1021/jp2071452 　

    ISSN： 1932-7447

  65. Structural basis for supercooled liquid fragility established by synchrotron-radiation method and computer simulation Peer-reviewed

    D. V. Louzguine-Luzgin, R. Belosludov, A. R. Yavari, K. Georgarakis, G. Vaughan, Y. Kawazoe, T. Egami, A. Inoue

    JOURNAL OF APPLIED PHYSICS　110　(4)　043519　2011/08

    DOI： 10.1063/1.3624745 　

    ISSN： 0021-8979

    eISSN： 1089-7550

  66. Thermodynamic stability of C3H8 hydrate of cubic structure IV using lattice dynamics Peer-reviewed

    Maaouia Souissi, Rodion V. Belosludov, Oleg S. Subbotin, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Vladimir R. Belosludov

    JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY　69　(1-2)　281-286　2011/02

    DOI： 10.1007/s10847-010-9845-x 　

    ISSN： 1388-3127

    eISSN： 1573-1111

  67. Electron transport characteristics of organic molecule encapsulated carbon nanotubes Peer-reviewed

    Sang Uck Lee, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    NANOSCALE　3　(4)　1773-1779　2011

    DOI： 10.1039/c0nr00757a 　

    ISSN： 2040-3364

    eISSN： 2040-3372

  68. Carbon Nanotubes Oscillation under Electric Field Peer-reviewed

    Mohammad Khazaei, Amir Abbas Farajian, Sang Uck Lee, Rodion Vladimir Belosludov, Yoshiyuki Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS　49　(11)　115103　2010/11

    DOI： 10.1143/JJAP.49.115103 　

    ISSN： 0021-4922

  69. Theoretical investigation on the alkali-metal doped BN fullerene as a material for hydrogen storage Peer-reviewed

    Natarajan Sathiyamoorthy Venkataramanan, Rodion Vladimirovich Belosludov, Ryunosuke Note, Ryoji Sahara, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    CHEMICAL PHYSICS　377　(1-3)　54-59　2010/11

    DOI： 10.1016/j.chemphys.2010.08.015 　

    ISSN： 0301-0104

    eISSN： 1873-4421

  70. Thermodynamic phase behavior of binary clathrate hydrates: Computational prediction Peer-reviewed

    V. R. Belosludov, O. S. Subbotin, R. V. Belosludov, H. Mizuseki, Y. Kawazoe

    COMPUTATIONAL MATERIALS SCIENCE　49　(4)　S187-S193　2010/10

    DOI： 10.1016/j.commatsci.2010.02.017 　

    ISSN： 0927-0256

  71. Ab initio Simulation of Chemical CO2 Adsorption Process

    Koji WAKUTA, Kohei SASAKI, Shigeru UEDA, Ryo INOUE, R.BELOSLUDOV, Yoshiyuki KAWAZOE, Tatsuro ARIYAMA

    The Fourth General Meeting of ACCMS-VO (Asian Consortium on Computational Materials Science - Virtual Organization)　2010/01/12

  72. Modular, Homochiral, Porous Coordination Polymers: Rational Design, Enantioselective Guest Exchange Sorption and Ab Initio Calculations of Host-Guest Interactions Peer-reviewed

    Danil N. Dybtsev, Maxim P. Yutkin, Denis G. Samsonenko, Vladimir P. Fedin, Alexey L. Nuzhdin, Andrey A. Bezrukov, Konstantin P. Bryliakov, Evgeniy P. Talsi, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Oleg S. Subbotin, Vladimir R. Belosludov

    CHEMISTRY-A EUROPEAN JOURNAL　16　(34)　10348-10356　2010

    DOI： 10.1002/chem.201000522 　

    ISSN： 0947-6539

  73. Accurate description of phase diagram of clathrate hydrates at the molecular level Peer-reviewed

    Rodion V. Belosludov, Oleg S. Subbotin, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Vladimir R. Belosludov

    JOURNAL OF CHEMICAL PHYSICS　131　(24)　244510-1-244510-12　2009/12

    DOI： 10.1063/1.3276282 　

    ISSN： 0021-9606

  74. Theoretical study of phase transitions in Kr and Ar clathrate hydrates from structure II to structure I under pressure Peer-reviewed

    Oleg S. Subbotin, Tatiana P. Adamova, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Jun-ichi Kudoh, P. M. Rodger, Vladimir R. Belosludov

    JOURNAL OF CHEMICAL PHYSICS　131　(11)　114507-1-114507-8　2009/09

    DOI： 10.1063/1.3212965 　

    ISSN： 0021-9606

    eISSN： 1089-7690

  75. TD-DFT Studies on Hematoporphyrin and Its Dimers Peer-reviewed

    A. Suvitha, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, M. Takeda, M. Kohno, N. Ohuchi

    J. Jpn. Inst. Met.　73　(8)　555-558　2009/08

    DOI： 10.2320/jinstmet.73.555 　

  76. Designing Nanogadgetry for Nanoelectronic Devices with Nitrogen-Doped Capped Carbon Nanotubes Peer-reviewed

    Sang Uck Lee, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    SMALL　5　(15)　1769-1775　2009/08

    DOI： 10.1002/smll.200801938 　

    ISSN： 1613-6810

    eISSN： 1613-6829

  77. Thermodynamics and Hydrogen Storage Ability of Binary Hydrogen + Help Gas Clathrate Hydrate Peer-reviewed

    V. R. Belosludov, O. S. Subbotin, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, J. Kudoh

    International Journal of Nanoscience　8　(1-2)　57-63　2009/04

    DOI： 10.1142/S0219581X0900589X 　

  78. Ultra-Stable Nanoparticles in A(II)B(VI) (A(II) = Cd, Zn; B-VI = S, Se, Te) Compounds Peer-reviewed

    V. R. Romanyuk, I. M. Dmitruk, Yu. A. Barnakov, R. V. Belosludov, A. Kasuya

    JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY　9　(3)　2111-2118　2009/03

    DOI： 10.1166/jnn.2009.433 　

    ISSN： 1533-4880

    eISSN： 1533-4899

  79. ZnO clusters: Laser ablation production and time-of-flight mass spectroscopic study Peer-reviewed

    A. Dmytruk, I. Dmitruk, I. Blonskyy, R. Belosludov, Y. Kawazoe, A. Kasuya

    MICROELECTRONICS JOURNAL　40　(2)　218-220　2009/02

    DOI： 10.1016/j.mejo.2008.07.010 　

    ISSN： 0026-2692

  80. Glass-transition behavior of Ni: Calculation, prediction, and experiment Peer-reviewed

    Dmitri V. Louzguine-Luzgin, Rodion Belosludov, Masatoshi Saito, Yoshiyuki Kawazoe, Akihisa Inoue

    JOURNAL OF APPLIED PHYSICS　104　(12)　Art.No.123529　2008/12

    DOI： 10.1063/1.3042240 　

    ISSN： 0021-8979

  81. Structural Dependence of Magnetic Shielding Properties in Al4Li4 Clusters Peer-reviewed

    Sang Uck Lee, Young-Kyu Han, Chiranjib Majumder, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    MATERIALS TRANSACTIONS　49　(11)　2429-2436　2008/11

    DOI： 10.2320/matertrans.MB200823 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  82. TD-DFT Studies on Hematoporphyrin and Its Dimers Peer-reviewed

    A. Suvitha, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, M. Takeda, M. Kohno, N. Ohuchi

    MATERIALS TRANSACTIONS　49　(11)　2416-2419　2008/11

    DOI： 10.2320/matertrans.MB200829 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  83. Crystal-like low frequency phonons in the low-density amorphous and high-density amorphous ices Peer-reviewed

    R. V. Belosludov, O. S. Subbotin, H. Mizuseki, P. M. Rodger, Y. Kawazoe, V. R. Belosludov

    JOURNAL OF CHEMICAL PHYSICS　129　(11)　Art.No.114507　2008/09

    DOI： 10.1063/1.2977975 　

    ISSN： 0021-9606

  84. The role of aromaticity and the pi-conjugated framework in multiporphyrinic systems as single-molecule switches Peer-reviewed

    Sang Uck Lee, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    SMALL　4　(7)　962-969　2008/07

    DOI： 10.1002/smll.200701220 　

    ISSN： 1613-6810

    eISSN： 1613-6829

  85. Transport properties of nanoscale materials for molecular wire applications: A case study of ferrocene dimers Peer-reviewed

    Hiroshi Mizuseki, Rodion V. Belosludov, Tomoki Uehara, Sang Uck Lee, Yoshiyuki Kawazoe

    JOURNAL OF THE KOREAN PHYSICAL SOCIETY　52　(4)　1197-1201　2008/04

    ISSN： 0374-4884

  86. Influence of molecular geometry, exchange-correlation functional, and solvent effects in the modeling of vertical excitation energies in phthalocyanines using time-dependent density functional theory (TDDFT) and polarized continuum model TDDFT methods: Ca Peer-reviewed

    Victor N. Nemykin, Ryan G. Hadt, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    J. Phys. Chem. A　111　(50)　12901-12913　2007/12

    DOI： 10.1021/jp0759731 　

  87. Control of electron transport by manipulating the conjugated framework Peer-reviewed

    Sang Uck Lee, Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    JOURNAL OF PHYSICAL CHEMISTRY C　111　(42)　15397-15403　2007/10

    DOI： 10.1021/jp074294n 　

    ISSN： 1932-7447

  88. Formation and atomic structure of boron nitride nanotubes with a cup-stacked structure Peer-reviewed

    Takeo Oku, Naruhiro Koi, Katsuaki Suganuma, Rodion V. Belosludov, Yoshiyuki Kawazoe

    SOLID STATE COMMUNICATIONS　143　(6-7)　331-336　2007/08

    DOI： 10.1016/j.ssc.2007.05.035 　

    ISSN： 0038-1098

  89. Modeling the self-preservation effect in gas hydrate/ice systems Peer-reviewed

    O. S. Subbotin, V. R. Belosludov, T. Ikeshoji, E. N. Brodskaya, E. M. Piotrovskaya, V. Sizov, R. V. Belosludov, Y. Kawazoe

    MATERIALS TRANSACTIONS　48　(8)　2114-2118　2007/08

    DOI： 10.2320/matertrans.N-MRA2007866 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  90. Gate-induced switching and negative differential resistance in a single-molecule transistor: Emergence of fixed and shifting states with molecular length Peer-reviewed

    A. A. Farajian, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, T. Hashizume, B. I. Yakobson

    JOURNAL OF CHEMICAL PHYSICS　127　(2)　0249011-0249015　2007/07

    DOI： 10.1063/1.2748047 　

    ISSN： 0021-9606

  91. Physical and chemical properties of gas hydrates: Theoretical aspects of energy storage application Peer-reviewed

    Vladimir R. Belosludov, Oleg S. Subbotin, Dmitrii S. Krupskii, Rodion V. Belosludov, Yoshiyuki Kawazoe, Jun-ichi Kudoh

    MATERIALS TRANSACTIONS　48　(4)　704-710　2007/04

    DOI： 10.2320/matertrans.48.704 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  92. Electronic and transport properties of bismuth nanolines for applications in molecular electronics Peer-reviewed

    R. V. Belosludov, A. A. Farajian, H. Mizuseki, K. Miki, Y. Kawazoe

    PHYSICAL REVIEW B　75　(11)　Art.No. 113411　2007/03

    DOI： 10.1103/PhysRevB.75.113411 　

    ISSN： 1098-0121

  93. Excited state properties and quadratic optical nonlinearities in charged organic chromophores: Theoretical analysis Peer-reviewed

    Talgat M. Inerbaev, Shigeki Saito, Rodion V. Belosludov, Hiroshi Mizuseki, Masae Takahashi, Yoshiyuki Kawazoe

    JOURNAL OF CHEMICAL PHYSICS　125　(23)　234702-1-234702-8　2006/12

    DOI： 10.1063/1.2403864 　

    ISSN： 0021-9606

    eISSN： 1089-7690

  94. First excited state properties and static hyperpolarizability of ruthenium(II) ammine complexes Peer-reviewed

    Talgat M. Inerbaev, Rodion V. Belosludov, Hiroshi Mizuseki, Masae Takahashi, Yoshiyuki Kawazoe

    JOURNAL OF CHEMICAL THEORY AND COMPUTATION　2　(5)　1325-1334　2006/09

    DOI： 10.1021/ct050193m 　

    ISSN： 1549-9618

    eISSN： 1549-9626

  95. Theoretical study of conductance properties of metallocene Peer-reviewed

    T. Uehara, N. Igarashi, R. V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    J. Jap. Inst. Met　70　(6)　478-482　2006/06

    DOI： 10.2320/jinstmet.70.478 　

  96. Theoretical study of polarons and self-trapped excited states in one-dimensional C-60 crystal Peer-reviewed

    VR Belosludov, TM Inerbaev, R Belosludov, Y Kawazoe, J Kudoh

    COMPUTATIONAL MATERIALS SCIENCE　36　(1-2)　17-25　2006/05

    DOI： 10.1016/j.commatsci.2005.01.014 　

    ISSN： 0927-0256

  97. Dynamics and equation of state of hydrogen clathrate hydrate as a function of cage occupation Peer-reviewed

    TM Inerbaev, VR Belosludov, RV Belosludov, M Sluiter, Y Kawazoe

    COMPUTATIONAL MATERIALS SCIENCE　36　(1-2)　229-233　2006/05

    DOI： 10.1016/j.commatsci.2005.03.022 　

    ISSN： 0927-0256

  98. Realization of molecular interconnection for molecular electronics: Theoretical aspects Peer-reviewed

    RV Belosludov, AA Farajian, Y Kikuchi, H Mizuseki, Y Kawazoe

    COMPUTATIONAL MATERIALS SCIENCE　36　(1-2)　130-134　2006/05

    DOI： 10.1016/j.commatsci.2004.11.012 　

    ISSN： 0927-0256

  99. Modelling of the structure and vibrational properties of LDA, HDA, and VHDA amorphous ices Peer-reviewed

    OS Subbotin, VR Belosludov, TM Inerbaev, RV Belosludov, Y Kawazoe

    COMPUTATIONAL MATERIALS SCIENCE　36　(1-2)　253-257　2006/05

    DOI： 10.1016/j.commatsci.2005.02.023 　

    ISSN： 0927-0256

  100. Electronic and transport properties of ferrocene: Theoretical study Peer-reviewed

    T Uehara, RV Belosludov, AA Farajian, H Mizuseki, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS BRIEF COMMUNICATIONS & REVIEW PAPERS　45　(4B)　3768-3771　2006/04

    DOI： 10.1143/JJAP.45.3768 　

    ISSN： 0021-4922

  101. Electronic and magnetic properties of double-impurities-doped TiO2 (rutile): First-principles calculations Peer-reviewed

    P. Murugan, R. V. Belosludov, H. Mizuseki, T. Nishimatsu, T. Fukumura, M. Kawasaki, Y. Kawazoe

    JOURNAL OF APPLIED PHYSICS　99　(8)　08M105-1-08M105-3　2006/04

    DOI： 10.1063/1.2165108 　

    ISSN： 0021-8979

  102. A general-purpose approach for calculating transport in contact-molecule-contact systems: TARABORD implementation and application to a polythiophene-based nanodevice Peer-reviewed

    AA Farajian, RV Belosludov, H Mizuseki, Y Kawazoe

    THIN SOLID FILMS　499　(1-2)　269-274　2006/03

    DOI： 10.1016/j.tsf.2005.07.122 　

    ISSN： 0040-6090

  103. Microscopic model of clathrate compounds Peer-reviewed

    V. R. Belosludov, O. S. Subbotin, D. S. Krupskii, O. V. Prokuda, R. V. Belosludov, Y. Kawazoe

    Journal of Physics: Conference Series　29　(1)　1-7　2006/01/01

    Publisher: Institute of Physics Publishing

    DOI： 10.1088/1742-6596/29/1/001 　

    ISSN： 1742-6596 1742-6588

  104. Thermodynamic properties of hydrate phases immersed in ice phase Peer-reviewed

    V. R. Belosludov, O. S. Subbotin, D. S. Krupskii, T. Ikeshoji, R. V. Belosludov, Y. Kawazoe, J. Kudoh

    Journal of Physics: Conference Series　29　(1)　198-205　2006/01/01

    Publisher: Institute of Physics Publishing

    DOI： 10.1088/1742-6596/29/1/039 　

    ISSN： 1742-6596 1742-6588

  105. Local pressure and density distribution in methane hydrate - Ice Ih system Peer-reviewed

    O. S. Subbotin, T. Ikeshoji, V. R. Belosludov, J. Kudoh, R. V. Belosludov, Y. Kawazoe

    Journal of Physics: Conference Series　29　(1)　206-209　2006/01/01

    Publisher: Institute of Physics Publishing

    DOI： 10.1088/1742-6596/29/1/040 　

    ISSN： 1742-6596 1742-6588

  106. Theoretical study on junctions in porphyrin oligomers for nanoscale devices Peer-reviewed

    H Mizuseki, RV Belosludov, AA Farajian, N Igarashi, Y Kawazoe

    MATERIALS SCIENCE & ENGINEERING C-BIOMIMETIC AND SUPRAMOLECULAR SYSTEMS　25　(5-8)　718-721　2005/12

    DOI： 10.1016/j.msec.2005.07.012 　

    ISSN： 0928-4931

  107. Stoichiometric and ultra-stable nanoparticles of II-VI compound semiconductors Peer-reviewed

    A Kasuya, Y Noda, Dmitruk, I, Romanyuk, V, Y Barnakov, K Tohji, Kumar, V, R Belosludov, Y Kawazoe, N Ohuchi

    EUROPEAN PHYSICAL JOURNAL D　34　(1-3)　39-41　2005/07

    DOI： 10.1140/epjd/e2005-00114-9 　

    ISSN： 1434-6060

    eISSN： 1434-6079

  108. Highly controlled acetylene accommodation in a metal-organic microporous material Peer-reviewed

    R Matsuda, R Kitaura, S Kitagawa, Y Kubota, RV Belosludov, TC Kobayashi, H Sakamoto, T Chiba, M Takata, Y Kawazoe, Y Mita

    NATURE　436　(7048)　238-241　2005/07

    DOI： 10.1038/nature03852 　

    ISSN： 0028-0836

  109. Electronic and transport properties of doped organic molecules for molecular wire applications Peer-reviewed

    RV Belosludov, AA Farajian, H Baba, H Mizuseki, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS BRIEF COMMUNICATIONS & REVIEW PAPERS　44　(4B)　2823-2825　2005/04

    DOI： 10.1143/JJAP.44.2823 　

    ISSN： 0021-4922

  110. TiO2(rutile) doped with double impurities for fabricating spintronic devices - a combinatorial computational approach Peer-reviewed

    P Murugan, RV Belosludov, H Mizuseki, T Nishimatsu, T Fukumura, M Kawasaki, Y Kawazoe

    MEASUREMENT SCIENCE AND TECHNOLOGY　16　(1)　242-247　2005/01

    DOI： 10.1088/0957-0233/16/1/032 　

    ISSN： 0957-0233

    eISSN： 1361-6501

  111. Structure and electronic properties of metal di-(4-thiophenyl)-porphyrin Peer-reviewed

    Y Kikuchi, RV Belosludov, H Baba, AA Farajian, H Mizuseki, Y Kawazoe

    MOLECULAR SIMULATION　30　(13-15)　929-933　2004/11

    DOI： 10.1080/08927020412331298667 　

    ISSN： 0892-7022

  112. Design of new catalysts for ecological high-quality transportation fuels by combinatorial computational chemistry and tight-binding quantum chemical molecular dynamics approaches Peer-reviewed

    M Kubo, T Kubota, CH Jung, M Ando, S Sakahara, K Yajima, K Seki, R Belosludov, A Endou, S Takami, A Miyamoto

    CATALYSIS TODAY　89　(4)　479-493　2004/06

    DOI： 10.1016/j.cattod.2004.03.055 　

    ISSN： 0920-5861

    eISSN： 1873-4308

  113. Ab initio study of hydrogen storage in hydrogen hydrate clathrates Peer-reviewed

    MHF Sluiter, H Adachi, RV Belosludov, VR Belosludov, Y Kawazoe

    MATERIALS TRANSACTIONS　45　(5)　1452-1454　2004/05

    DOI： 10.2320/matertrans.45.1452 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  114. Electron transport in molecular enamel wires Peer-reviewed

    RV Belosludov, AA Farajian, H Mizuseki, K Ichinoseki, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS SHORT NOTES & REVIEW PAPERS　43　(4B)　2061-2063　2004/04

    DOI： 10.1143/JJAP.43.2061 　

    ISSN： 0021-4922

  115. Theoretical study of clathrate hydrates with multiple occupation Peer-reviewed

    TM Inerbaev, VR Belosludov, RV Belosludov, M Sluiter, Y Kawazoe, JI Kudoh

    JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY　48　(1-2)　55-60　2004/02

    DOI： 10.1023/B:JIPH.0000016590.88107.ec 　

    ISSN： 1388-3127

    eISSN： 1573-1111

  116. Ultra-stable nanoparticles of CdSe revealed from mass spectrometry Peer-reviewed

    A Kasuya, R Sivamohan, YA Barnakov, IM Dmitruk, T Nirasawa, VR Romanyuk, Kumar, V, SV Mamykin, K Tohji, B Jeyadevan, K Shinoda, T Kudo, O Terasaki, Z Liu, RV Belosludov, Sundararajan, V, Y Kawazoe

    NATURE MATERIALS　3　(2)　99-102　2004/02

    DOI： 10.1038/nmat1056 　

    ISSN： 1476-1122

    eISSN： 1476-4660

  117. Genetic algorithm approach to aromatic molecules for nanoscale device Peer-reviewed

    H Mizuseki, N Igarashi, RV Belosludov, AA Farajian, Y Kawazoe

    MATERIALS SCIENCE & ENGINEERING C-BIOMIMETIC AND SUPRAMOLECULAR SYSTEMS　23　(6-8)　807-809　2003/12

    DOI： 10.1016/j.mesc.2003.09.129 　

    ISSN： 0928-4931

  118. Ab initio study of hydrogen hydrate clathrates for hydrogen storage within the ITBL environment Peer-reviewed

    M.H.F. Sluiter, R. V. Belosludov, A. Jain, V. R. Belosludov, H. Adachi, Y. Kawazoe, K. Higuchi, T. Otani

    LECT. NOTES COMPUT. SC.　2858　330-341　2003/10

    DOI： 10.1007/b14207 　

  119. Thermal expansion and lattice distortion of clathrate hydrates of cubic structures I and II Peer-reviewed

    Vladimir R. Belosludov, Talgat M. Inerbaev, Oleg S. Subbotin, Rodion V. Belosludov, Jun-Ichi Kudoh, Yoshiyuki Kawazoe

    Journal of Supramolecular Chemistry　2　(4-5)　453-458　2003/08

    DOI： 10.1016/S1472-7862(03)00072-8 　

    ISSN： 1472-7862

  120. Absolute stability boundaries of clathrate hydrates of cubic structure II Peer-reviewed

    Vladimir R. Belosludov, Talgat M. Inerbaev, Rodion V. Belosludov, Jun-Ichi Kudoh, Yoshiyuki Kawazoe

    Journal of Supramolecular Chemistry　2　(4-5)　377-383　2003/08

    DOI： 10.1016/S1472-7862(03)00062-5 　

    ISSN： 1472-7862

  121. Theoretical study of donor-spacer-acceptor structure molecule for use as stable molecular rectifier: geometric and electronic structures Peer-reviewed

    H Mizuseki, N Igarashi, C Majumder, RV Belosludov, AA Farajian, Y Kawazoe

    THIN SOLID FILMS　438　235-237　2003/08

    DOI： 10.1016/S0040-6090(03)00782-X 　

    ISSN： 0040-6090

  122. Theoretical study of insulated wires based on polymer chains encapsulated in molecular nanotubes Peer-reviewed

    RV Belosludov, H Sato, AA Farajian, H Mizuseki, Y Kawazoe

    THIN SOLID FILMS　438　80-84　2003/08

    DOI： 10.1016/S0040-6090(03)00769-7 　

    ISSN： 0040-6090

  123. Molecular orbital analysis of frontier orbitals for molecular electronics: a case study of unimolecular rectifier and photovoltaic cell Peer-reviewed

    Hiroshi Mizuseki, Rodion V. Belosludov, Amir A. Farajian, Nobuaki Igarashi, Jian-Tao Wang, Hao Chen, Chiranjib Majumder, Shigeyuki Miura, Yoshiyuki Kawazoe

    SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS　4　(4)　377-382　2003/07

    DOI： 10.1016/S1468-6996(03)00061-5 　

    ISSN： 1468-6996

  124. Theoretical study of phthalocyanine-fullerene complex for a high efficiency photovoltaic device using ab initio electronic structure calculation Peer-reviewed

    H Mizuseki, N Igarashi, RV Belosludov, AA Farajian, Y Kawazoe

    SYNTHETIC METALS　138　(1-2)　281-283　2003/06

    DOI： 10.1016/S0379-6779(02)01289-4 　

    ISSN： 0379-6779

  125. Electronic transport through benzene molecule: effect of gold contacts Peer-reviewed

    AA Farajian, RV Belosludov, H Mizuseki, Y Kawazoe

    PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES　18　(1-3)　253-254　2003/05

    DOI： 10.1016/S1386-9477(02)01005-6 　

    ISSN： 1386-9477

  126. Polaron in a one-dimensional C60 crystal

    V. R. Belosludov, T. M. Inerbaev, R. V. Belosludov, Y. Kawazoe

    Physical Review B - Condensed Matter and Materials Physics　67　(15)　1554101-1554108　2003/04

    ISSN： 0163-1829

  127. Theoretical Study of Donor - Spacer - Acceptor Structure Molecule for Stable Molecular Rectifier Peer-reviewed

    H. Mizuseki, K. Niimura, C. Majumder, R. V. Belosludov, A. A. Farajian, Y. Kawazoe

    Molecular Crystals and Liquid Crystals　406　195-204　2003/04

    DOI： 10.1080/744818981 　

  128. Theoretical Study of Molecular Enamel Wire based on Polythiophene- Cyclodextrin Inclusion Complexes Peer-reviewed

    R. V. Belosludov, H. Sato, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    Molecular Crystals and Liquid Crystals　406　205-211　2003/04

    DOI： 10.1080/15421400390257773 　

  129. Dynamical, theromdynamical and mechanical properties of gas hydrate of structure I and II Peer-reviewed

    T. M. Inerbaev, O. Subbotin, V. R. Belosludov, R. V. Belosludov, Y. Kawazoe, J. Kudoh

    Russian Chemical Journal XLVII　3　19-27　2003/04

  130. Polaron in a one-dimensional C-60 crystal Peer-reviewed

    VR Belosludov, TM Inerbaev, RV Belosludov, Y Kawazoe

    PHYSICAL REVIEW B　67　(15)　1554101-1554108　2003/04

    DOI： 10.1103/PhysRevB.67.155410 　

    ISSN： 1098-0121

  131. Theoretical study of chlorin-fullerene supramolecular complexes for photovoltaic devices Peer-reviewed

    H Mizuseki, N Igarashi, RV Belosludov, AA Farajian, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS SHORT NOTES & REVIEW PAPERS　42　(4B)　2503-2505　2003/04

    DOI： 10.1143/JJAP6.42.2503 　

    ISSN： 0021-4922

  132. Molecular enamel wires for electronic devices: Theoretical study Peer-reviewed

    RV Belosludov, H Sato, AA Farajian, H Mizuseki, K Ichinoseki, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS SHORT NOTES & REVIEW PAPERS　42　(4B)　2492-2494　2003/04

    DOI： 10.1143/JJAP.42.2492 　

    ISSN： 0021-4922

  133. Theoretical, study of donor-spacer-acceptor structure molecule for stable molecular rectifier Peer-reviewed

    H. Mizuseki, K. Niimura, C. Majumder, R. V. Belosludov, A. A. Farajian, Y. Kawazoe, C. Majumder

    Molecular Crystals and Liquid Crystals　406　11-17　2003

    Publisher: Taylor and Francis Inc.

    DOI： 10.1080/744818982 　

    ISSN： 1542-1406

  134. Fullerene and sulfur compounds Peer-reviewed

    H Takahashi, E Matsubara, RV Belosludov, S Matsubara, N Sato, A Muramatsu, Y Kawazoe, K Tohji

    MATERIALS TRANSACTIONS　43　(7)　1530-1532　2002/07

    DOI： 10.2320/matertrans.43.1530 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  135. Combinatorial computational chemistry approach as a promising method for design of Fischer-Tropsch catalysts based on Fe and Co

    RV Belosludov, S Sakahara, K Yajima, S Takami, M Kubo, A Miyamoto

    APPLIED SURFACE SCIENCE　189　(3-4)　245-252　2002/04

    DOI： 10.1016/S0169-4332(01)01018-2 　

    ISSN： 0169-4332

  136. Combinatorial computational chemistry approach to the design of methanol synthesis catalyst Peer-reviewed

    S Sakahara, K Yajima, R Belosludov, S Takami, M Kubo, A Miyamoto

    APPLIED SURFACE SCIENCE　189　(3-4)　253-259　2002/04

    DOI： 10.1016/S0169-4332(01)01018-2 　

    ISSN： 0169-4332

  137. Theoretical study on inclusion complex of polyaniline covered by cyclodextrins for molecular device Peer-reviewed

    RV Belosludov, H Mizuseki, K Ichinoseki, Y Kawazoe

    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS SHORT NOTES & REVIEW PAPERS　41　(4B)　2739-2741　2002/04

    DOI： 10.1143/JJAP.41.2739 　

    ISSN： 0021-4922

  138. Simulation Study on Geometric and Electronic Structure of Photovoltaic Molecules Peer-reviewed

    H. Mizuseki, N. Igarashi, C. Majumder, R. V. Belosludov, A. A. Farajian, J.-T. Wang, H. Chen, Y. Kawazoe

    Materials Research Society Symposium Proceedings　725　199-203　2002

  139. Theoretical study on Fe-based metal clusters: Application in heterogeneous catalysis Peer-reviewed

    RV Belosludov, S Takami, M Kubo, A Miyamoto, Y Kawazoe

    MATERIALS TRANSACTIONS　42　(11)　2180-2183　2001/11

    DOI： 10.2320/matertrans.42.2180 　

    ISSN： 1345-9678

    eISSN： 1347-5320

  140. Molecular dynamics calculations of CO2/N-2 mixture through the NaY type zeolite membrane Peer-reviewed

    K Mizukami, H Takaba, Y Kobayashi, Y Oumi, RV Belosludov, S Takami, M Kubo, A Miyamoto

    JOURNAL OF MEMBRANE SCIENCE　188　(1)　21-28　2001/06

    DOI： 10.1016/S0376-7388(00)00693-1 　

    ISSN： 0376-7388

  141. Elastic moduli and stability of ices and clathrate hydrates of cubic structure I Peer-reviewed

    V. R. Belosludov, T. M. Inerbaev, V. P. Shpakov, J. Tse, R. V. Belosludov, Y. Kawazoe

    Russian Chemical Journal XLV　3　45-50　2001/04

  142. Theoretical Design of Heterogeneous Catalysts by Combinatorial Computational Chemistry Approach: Application to Fischer-Tropsch Synthesis Peer-reviewed

    Rodion Belosludov, Tsuguo Kubota, Satoshi Sakahara, Kenji Yajima, Seiichi Takami, Momoji Kubo, Akira Miyamoto

    Proc. SPIE　4281　87-96　2001

    DOI： 10.1117/12.424750 　

  143. Design of Most Active Catalysts for Methanol Synthesis: Combinatorial Computational Chemistry Approach Peer-reviewed

    Satoshi Sakahara, Kenji Yajima, Rodion Belosludov, Seiichi Takami, Momoji Kubo, Akira Miyamoto

    Proc. SPIE　4281　97-102　2001

    DOI： 10.1117/12.424751 　

  144. First-principle study on reactions of diamond (100) surfaces with hydrogen and methyl radicals Peer-reviewed

    H. Tamura, H. Zhou, Y. Hirano, S. Takami, M. Kubo, R. V. Belosludov, A. Miyamoto, A. Imamura, M. N. Gamo, T. Ando

    Phys. Rev. B.　62　(24)　16995-17003　2000/12/15

    DOI： 10.1103/PhysRevB.62.16995 　

  145. Molecular dynamics studies of surface difference effect on gas separation by zeolite membranes Peer-reviewed

    K. Mizukami, Y. Kobayashi, H. Morito, S. Takami, M. Kubo, R. Belosludov, A. Miyamoto

    Jpn. J. Appl. Phys.　39　(7B)　4385-4388　2000/07/30

    DOI： 10.1143/JJAP.39.4385 　

  146. Density-functional theory of potassium atoms in zeolite Peer-reviewed

    KN Shrivastava, R Belosludov, N Zhanpeisov, S Takami, M Kubo, A Miyamoto

    CHEMICAL PHYSICS LETTERS　325　(1-3)　1-6　2000/07

    DOI： 10.1016/S0009-2614(00)00616-3 　

    ISSN： 0009-2614

  147. Mechanical stability of Gas Hydrates under Pressure Peer-reviewed

    V. R. Belosludov, V. P. Shpakov, J. S. Tse, R. V. Belosludov, Y. Kawazoe

    Annals New York Academy of Sciences　912　993-1002　2000/06

    DOI： 10.1111/j.1749-6632.2000.tb06854.x 　

  148. Periodic density functional study on adsorption properties of organic molecules on clean Al (111) surface Invited Peer-reviewed

    H Zhou, H Tamura, S Takami, M Kubo, R Belosloudov, N Zhanpeisov, A Miyamoto

    APPLIED SURFACE SCIENCE　158　(1-2)　38-42　2000/05

    DOI： 10.1016/S0169-4332(99)00584-X 　

    ISSN： 0169-4332

  149. Periodic density-functional study on oxidation of diamond (100) surfaces Peer-reviewed

    H Tamura, H Zhou, K Sugisako, Y Yokoi, S Takami, M Kubo, K Teraishi, A Miyamoto, A Imamura, MN Gamo, T Ando

    PHYSICAL REVIEW B　61　(16)　11025-11033　2000/04

    DOI： 10.1103/PhysRevB.61.11025 　

    ISSN： 1098-0121

    eISSN： 1550-235X

  150. Combinatorial Computational Chemistry Approach to the Design of Catalysts Peer-reviewed

    Kenji Yajima, Satoshi Sakahara, Yusuke Ueda, Rodion Belosludov, Seiichi Takami, Momoji Kubo, Akira Miyamoto

    Proc. SPIE　3941　62-69　2000

  151. Combinatorial Computational Chemistry Approach to the Design of Metal Oxide Electronics Materials Peer-reviewed

    Rodion Belosludov, S. Salai, Cheettu Ammal, Yusaku Inaba, Yasunori Oumi, Seiichi Takami, Momoji Kubo, Akira Miyamoto, Masashi Kawasaki, Mamoru Yoshimoto, Hideomi Koinuma

    Proc. SPIE　3941　2-10　2000

  152. Ab initio and lattice dynamics studies of the vibrational and geometrical properties of the molecular complex of hydroquinone and C-60 Peer-reviewed

    RV Belosludov, M Sluiter, ZQ Li, Y Kawazoe

    CHEMICAL PHYSICS LETTERS　312　(2-4)　299-305　1999/10

    DOI： 10.1016/S0009-2614(99)00951-3 　

    ISSN： 0009-2614

  153. The mechanisms for pressure-induced amorphization of ice I-h Peer-reviewed

    JS Tse, DD Klug, CA Tulk, Swainson, I, EC Svensson, CK Loong, Shpakov, V, VR Belosludov, RV Belosludov, Y Kawazoe

    NATURE　400　(6745)　647-649　1999/08

    DOI： 10.1038/23216 　

    ISSN： 0028-0836

  154. Ab initio and DFT study of the Structures, Vibrations, and Energetic of the Urea Dimer ans Trimer Peer-reviewed

    R. V. Belosludov, Z. Li, Y. Kawazoe

    Molecular Engineering　8　(2)　105-120　1999/06

    DOI： 10.1023/A:1008334322264 　

  155. Intermolecular bonds bridging two anthracene molecules in a gamma-cyclodextrin Peer-reviewed

    R Belosludov, T Hiwada, Y Kawazoe, K Ohno, T Yoshinari, A Ohnishi, S Nagasaka

    JOURNAL OF SOLID STATE CHEMISTRY　144　(2)　263-271　1999/05

    DOI： 10.1006/jssc.1999.8199 　

    ISSN： 0022-4596

    eISSN： 1095-726X

  156. Lattice dynamics of helium gas hydrates based on ice framework: dynamic and thermodynamic stability Peer-reviewed

    RV Belosludov, Y Kawazoe, EV Grachev, YA Dyadin, VR Belosludov

    SOLID STATE COMMUNICATIONS　109　(3)　157-162　1999

    DOI： 10.1016/S0038-1098(98)00530-4 　

    ISSN： 0038-1098

  157. Determination of Structures, Energetics, and Electronic Properties of Small Urea Clusters by ab initio Calculations Peer-reviewed

    R. V. Belosludov, Z. Li, Y. Kawazoe

    J. Inorg. Biochem.　67　(1-4)　453　1997/09

    DOI： 10.1016/S0162-0134(97)80313-3 　

  158. Elastic moduli and instability in molecular crystals Peer-reviewed

    VP Shpakov, JS Tse, VR Belosludov, RV Belosludov

    JOURNAL OF PHYSICS-CONDENSED MATTER　9　(27)　5853-5865　1997/07

    DOI： 10.1088/0953-8984/9/27/015 　

    ISSN： 0953-8984

  159. Numerical simulation of scattering of molecules of tris(dipivaloymethane) yttrium (Y(C11H19O2)3) in the potential field of crystal MgO Peer-reviewed

    R. V. Belosludov, I. K. Igumenov, I. F. Golovnev, A. P. Kalinina, O. V. Khokhlov

    Thin Solid Films　292　(1-2)　43-49　1997/01/05

    DOI： 10.1016/S0040-6090(96)09074-8 　

  160. The lattice dynamics of ß-hydroquinone clathrate Peer-reviewed

    R. V. Belosludov, V. R. Belosludov, V. E. Zubkus

    J. Chem. Phys.　103　(8)　2773-2778　1995/08/22

    DOI： 10.1063/1.470513 　

  161. Dynamical and thermodynamical properties of the acetylacetones of cooper, aluminium, indium, and rodium Peer-reviewed

    R. V. Belosludov, I. K. Igumenov, V. R. Belosludov, V. P. Shpakov

    Molecular Physics　82　(1)　51-66　1994/04

    DOI： 10.1080/00268979400100054 　

  162. Simulation of low-temperature phases of solid C60 Peer-reviewed

    V. P. Shpakov, R. V. Belosludov, V. R. Belosludov

    Superconductivity: physics, chemistry, technique　7　1163　1994/04

Show all ︎Show first 5

Misc. 9

  1. Preface

    R. V. Belosludov, A. S. Zolkin, T. Goto

    MATERIALS TODAY-PROCEEDINGS　4　(11)　11325-11326　2017

    DOI： 10.1016/j.matpr.2017.09.001 　

  2. Thermodynamic stability of C3H8 hydrate of cubic structure IV using lattice dynamics

    Maaouia Souissi, Rodion V. Belosludov, Oleg S. Subbotin, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Vladimir R. Belosludov

    Journal of Inclusion Phenomena and Macrocyclic Chemistry　69　(1-2)　281-286　2011/02

    DOI： 10.1007/s10847-010-9845-x 　

    ISSN： 0923-0750

  3. 第一原理計算シミュレーションを用いた固体CO2吸収材の探査

    佐々木光平, 徳田夏樹, 植田 滋, 井上 亮, R. BELOSLUDOV, 川添良幸, 有山達郎

    2010年度第10回多元物質科学研究所研究発表会講演予稿集　83　2010

  4. 27aWR-6 Mass production and structural analysis on stable (CdSe)_<33>, (CdSe)_<34>

    Kasuya A., Romanyuk V., Kumar V., Belosludov R., Kawazoe Y.

    Meeting abstracts of the Physical Society of Japan　59　(1)　884-884　2004/03/03

    Publisher: The Physical Society of Japan (JPS)

    ISSN： 1342-8349

  5. Realization of Coated Condutor for Nanotechnology by Conductive Polymer Covered by Cyclodextrins

    Takeshi Shimomura, Kohzo Itoh, H1iroshi Mizuseki, Rodion Belosludov, Amir Farajian, Hao Chen, Yoshiyuki Kawazoe

    ナノ学会会報　1　(2)　67-71　2003/10

  6. 分子被覆導線の構造と物性

    下村武志, 伊藤耕三, 水関博志, Rodion Belosludov, Amir Farajian, Hao Chen, 川添良幸

    平成１４年度東北大学金属材料研究所研究部共同研究報告　140-141　2003/06

  7. ビスマス原子細線の原子構造と電気伝導度に関する研究

    三木一司, 矢代 航, 大橋勝文, 成島哲也, 白木一郎, Rodion Belosludov, Jian-Tao Wang, 水関博志, 川添良幸

    平成１４年度東北大学金属材料研究所研究部共同研究報告　189　2003/06

  8. 第一原理計算によるZnP-C60太陽電池の評価

    五十嵐伸昭, 水関博志, Rodion V. Belosludov, Amir A. Farajian, 川添良幸

    東北大学金属材料研究所技術部技術研究報告　20　65-68　2003/03

  9. 導電性ポリマーとシクロデキストリンによるナノテクノロジー用被覆導線実現

    下村武史, 伊藤耕三, 水関博志, R. Belosludov, A. Farajian, H. Chen, 川添良幸

    ナノ学会会報　1　(2)　67-71　2003

Show all ︎Show first 5

Books and Other Publications 7

  1. Handbook of Sustainable Engineering

    Rodion V. Belosludov, Hiroshi Mizuseki, R. Sahara, Yoshiyuki Kawazoe, Oleg S. Subbotin, Ravil K. Zhdanov, Vladimir R. Belosludov

    Springer, New York　2013

  2. HANDBOOK OF NANOPHYSICS - Principles and Methods

    Rodion V. Belosludov, Natarajan S. Venkataramanan, Hiroshi Mizuseki, Oleg S. Subbotin, Ryoji Sahara, Vladimir R. Belosludov, Yoshiyuki Kawazoe

    CRC Press, Taylor&Francis Group　2010

    ISBN: 9781420075403

  3. Boron Nitride Nanocage Clusters, Nanotubes, Nanohorns, Nanoparticles, and Nanocapsules

    Takeo Oku, Ichihito Narita, Naruhiro Koi, Atsushi Nishiwaki, Katsuaki Suganuma, Masahiro Inoue, Kenji Hiraga, Toshitsugu Matsuda, Makoto Hirabayashi, Hisato Tokoro, Shigeo Fujii, Makoto Gonda, Masahiko Nishijima, Toshio Hirai, Rodion V. Belosludov, Yoshiyuki Kawazoe

    Springer New York　2009/06

    ISBN: 9781441900852

  4. Calculating Transport Properties of Nanometer-scale Systems: Nanodevice Applications of Carbon Nanotubes and Organic Molecules

    A. A. Farajian, R. V. Belosludov, O. V. Pupysheva, H. Mizuseki, Y. Kawazoe

    Springer-Verlag, Berlin　2007

  5. Handbook of Theroretical and Computational Nanotechnology (Vol. 10), ed. by M. Reith and W. Schommers

    Y. Kawazoe, H. Mizuseki, R. Belosludov, A. Farajian

    American Scientific Publishers　2006

  6. Combinatorial Materials Synthesis

    R. V. Belosludov, S. Takami, M. Kubo, A. Miyamoto

    Marcel Dekker Inc　2003/08/01

  7. Clusters and Nanomaterials: Theory and Experiment

    R. V. Belosludov, T. Yoshinari, T. Hiwada, Y. Kawazoe, K. Ohno, S. Nagasaka

    Springer　2001/12/15

Show all Show first 5

Presentations 136

  1. Theoretical Study of Functionalized Carbon-Based Nanomaterials Including Defects and Dopants

    Rodion Belosludov, Victor Nemykin

    MRS Fall Meeting　2024/12/05

  2. Structure-property relationship of nanoporous materials: Theoretical aspects

    Rodion Belosludov

    the 10th International Symposium on Surface Science, ISSS-10　2024/10/22

  3. Universal Origin of Boson Peak Vibrational Anomalies in hexagonal and low density amorphous ices. International-coauthorship

    Rodion V. Belosludov, Kirill V. Gets, Ravil K. Zhdanov, Yulia Yu. Bozhko, Vladimir R. Belosludov

    9th International Discussion Meeting on Relaxation in Complex Systems (9IDMRCS)　2023/08/15

  4. Theoretical study of gas storage and separation in clathrate hydrates: Role of guest-host and guest-guest interactions.

    Rodion Belosludov, Yoshiyuki Kawazoe

    The 10th International Conference on Gas Hydrates　2023/07/11

  5. DFT study of hydrogen-evolution reaction on Mo-based alloys

    Rodion Belosludov, Ruirui Song, Jiuhui Han, Hidemi Kato

    MRS Fall Meeting　2022/12/01

  6. Theoretical study on functional defects and dopants in carbon-based nanomaterials Invited

    Rodion V. Belosludov

    21st International Union of Materials Research Societies- International Conference in Asia (IUMRS-ICA 2020) & MRS-Thailand 2021　2021/02/25

  7. Thermodynamic of Multicomponent Gas Hydrate Systems: Theoretical Aspects

    R. V. Belosludov, K. V. Gets, R. K. Zhdanov, Yu. Yu. Bozhko and V. R. Belosludov

    Natural Gas Hydrate Systems Gordon Research Conference　2020/02/23

  8. Dynamic inhomogeneity of hydrogen bonding network in TIP4P/2005 Water Invited

    BELOSLUDOV Vladimirovich Rodion

    Satellite Event Glass Workshop, The 3rd Symposium for The Core Research Clusters for Materials Science and Spintronics　2020/02/09

  9. Theoretical study on Tandem Solar Cell Configuration based on different Si allotropes International-presentation

    R. V. Belosludov, H. Morito

    MRS Fall Meeting　2019/12/02

  10. Conceptual design of multi-functional nanomaterials based on porphyrin subunits

    R. V. Belosludov

    ACS Publications Symposium: Innovation in Materials Science and Technology　2019/11/18

  11. Atomistic level description of functional materials International-presentation Invited

    R. V. Belosludov

    Hot topics in solid state chemistry: From new ideas to new materials (HTSSC 2019)　2019/10/02

  12. Theoretical study of porphyrin-based MOF structure for storage, separation and drug delivery applications International-presentation

    R. V. Belosludov

    258th ACS National Meeting　2019/08/28

  13. Atomistic-level description of stability and composition of multi-component clathrate hydrates International-presentation

    R. V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Y. Y. Bozhko, K. V. Gets, Y. Kawazoe, V. R. Belosludov

    258th ACS National Meeting　2019/08/27

  14. Structure-property relationship of nanoporous materials based on guest-host interaction International-presentation Invited

    R. V. Belosludov

    The 10th Conference of Asian Consortium for Computational Materials Science　2019/07/25

  15. Thermodynamic description of storage ability of nanoporous materials: Lattice dynamics and first-principles methods International-presentation

    R. V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Yu. Yu. Bozhko, K. V. Gets, Y. Kawazoe, V. R. Belosludov

    European Materials Research Society (E-MRS) Spring Meeting　2019/05/29

  16. Theoretical design of porphyrin-based nanostructures

    R. V. Belosludov, Y. Kawazoe

    17th Annual Meeting The Society of Nano Science and Technology　2019/05/09

  17. Theoretical study of Si clathrate/c-Si interface

    Rodion V. Belosludov, Haruhiko Morito

    2019 Spring Annual (164th) Meeting The Japan Institute of Metals and Materials　2019/03/21

  18. Theoretical study of gas adsorption/separation in nanoporous materials: Role of guest-host and guest-guest interactions International-presentation

    Rodion V. Belosludov

    6th International Conference on Multifunctional, Hybrid and Nanomaterials　2019/03/19

  19. Theoretical study on structure, electronic properties and catalytic activities of TiO2 nanoparticles International-presentation

    Rodion V. Belosludov

    Chemical Reactions at Surfaces Gordon Research Conference　2019/02/19

  20. Theoretical description of amorphous ices Invited

    BELOSLUDOV, Rodion Vladimirovich

    Satellite Event Glass Workshop The 2nd Symposium for Materials Science and Spintronics - 2019　2019/02/15

  21. Theoretical study on polymorphic transformations in amorphous ice International-presentation

    R. V. Belosludov, K. V. Gets, O. S. Subbotin, R. K. Zhdanov, V. R. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2018/11/29

  22. Theoretical aspects in realization of functional nanomaterials for energy and medical applications International-presentation Invited

    R. V. Belosludov

    Russia-Japan Joint Seminar Non-equilibrium processing of materials: experiments and modeling　2018/10/02

  23. Gas storage and separation in nanoporous materials: Role of interaction between adsorbed gas molecules International-presentation Invited

    R. V. Belosludov

    ACCMS-Theme Meeting on Multiscale Modelling of Materials for Sustainable Development　2018/09/08

  24. Functional nanomaterials for energy and medical applications: Theoretical aspects International-presentation Invited

    R. V. Belosludov

    Single Nanostructures, Nanomaterials, Aerogels and their Interactions: Combining Quantum Physics and Chemistry, International Workshop (CPQC18)　2018/08/30

  25. Role of guest-host and guest-guest interactions in selective gas adsorption mechanism in MOF materials: Theoretical aspects International-presentation

    R. V. Belosludov

    256th ACS National Meeting　2018/08/21

  26. Theoretical Aspects in Realization of Effective Gas Storage and Separation Media based of Gas Hydrates International-presentation

    R. V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Yu. Yu. Bozhko, K. V. Gets, Y. Kawazoe, V. R. Belosludov

    Natural Gas Hydrate Systems Gordon Research Conference　2018/02/28

  27. Theoretical aspects in realization of functional nanomaterials for energy and medical applications International-presentation Invited

    R. V. Belosludov

    The 12th General Meeting of ACCMS-VO　2017/12/17

  28. Conceptual design of the functional defects and dopants in carbon-based nanomaterials International-presentation

    R. Belosludov, V. Nemykin

    MRS Fall Meeting　2017/11/26

  29. Theoretical Study of Functional Carbon Nanomaterials based on tetraazaporphyrin subunits International-presentation Invited

    R. V. Belosludov

    2017 International Conference on Functional Carbons (2017 ICFC)　2017/11/01

  30. Role of Nano-sized TiO2 Particles in Catalytic Decomposition of Ammonium Perchlorate International-presentation

    Rodion V. Belosludov, Yoshiyuki Kawazoe

    254th ACS National Meeting　2017/08/20

  31. Design of Porphyrin-based Functional Nanoporous Materials International-presentation Invited

    R. V. Belosludov

    The 9th Conference of the Asian Consortium on Computational Materials Science (ACCMS-9)　2017/08/08

  32. Atomistic-level Description of Clathrate Hydrates Structure-property Relationships toward Gas Storage and Separation: Lattice Dynamics and First-principles Methods International-presentation

    R. V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Yu. Yu. Bozhko, K. V. Gets, Y. Kawazoe, V. R. Belosludov

    9th International Conference on Gas Hydrates　2017/06/25

  33. Theoretical study of electronic properties of atom/molecule structures International-presentation Invited

    R. V. Belosludov

    4th Seminar dedicated to the memory of Professor Fedor Kuznetsov: Problems of chemical deposition from the gas phase　2017/02/01

  34. Clathrate Hydrate for Energy Storage and Transport International-presentation Invited

    Rodion V. Belosludov, R. K, Zhdanov, Yu, Yu. Bozhko, K. V. Gets, O.S, Subbotin, V. R. Belosludov, Y. Kawazoe

    The 11th General Meeting of ACCMS-VO　2016/12/19

  35. Catalytic activity of nano-sized TiO2 particles toward decomposition of ammonium perchlorate International-presentation

    R. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2016/11/27

  36. Conceptual design of the tetraazaporphyrin-based functional nanocarbon materials International-presentation

    R. V. Belosludov, R. K. Zhdanov, V. R. Belosludov, H. M. Rhoda, V. N. Nemykin, Y. Kawazoe

    MRS Fall Meeting　2016/11/27

  37. Role of Computational Materials Science in realization of Advanced Energy Materials and Nanostructures International-presentation Invited

    R. V. Belosludov

    2016 Russia-Japan Conference Advanced Materials: Synthesis, Processing and Properties of Nanostructures　2016/10/30

  38. Nanoporous Materials for Gas Storage and Separation: Theoretical Aspects. International-presentation

    Rodion V. Belosludov, Yoshiyuki Kawazoe

    252th ACS National Meeting　2016/08/20

  39. Atomistic level description of amorphous soilds: Structural, dynamic and thermodynamic properties. International-presentation Invited

    23rd International Symposium on Metastable, Amorphous and Nanostructured Materials　2016/07/03

  40. Clathrate Hydrates as Materials for Hydrogen Storage Applications: Theoretical Aspects International-presentation Invited

    Rodion V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Y. Y. Bozhko, V. R. Belosludov, Y. Kawazoe

    Pacifichem 2015　2015/12/15

  41. Simulation Approach to Design of Nanoporous Materials for Gas Storage and Separation Application International-presentation

    Rodion V. Belosludov, O. S. Subbotin, R. K. Zhdanov, V. R. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2015/11/29

  42. Theoretical Study of Functional Nanoporous Materials International-presentation Invited

    Rodion V. Belosludov

    The 10th General Meeting of ACCMS-VO　2015/11/01

  43. Nanoporos Materials for Energy Storage: Theoretical Aspects International-presentation Invited

    Rodion V. Belosludov

    International Conference on Functional Materials for Frontier Energy Issues (ICFMFEI-2015)　2015/10/01

  44. Thermodynamic Properties of Carbon Dioxide Clathrate Hydrates toward CCUS application International-presentation

    Rodion V. Belosludov, Oleg Subbotin, Ravil Zhdanov, Vladimir Belosludov, Yoshiyuki Kawazoe

    250th ACS National Meeting　2015/08/16

  45. Theoretical Study on Gas Separation in MOF Structures. International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    The 9th General Meeting of ACCMS-VO　2014/12/20

  46. Theoretical Study of Molecular Separation in Nanoporous Materials for Realization Sustainable Future. International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2014/11/30

  47. Computational Approach to Design Materials for Gas Storage and Separation. International-presentation

    Rodion V. Belosludov, O. S. Subbotin, R. K. Zhdanov, V. R. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2014/11/30

  48. Atomictic Level Description of Nanoporous Materials for Gas Storage and Separation International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    4th International Conference on Metal-Organic Frameworks& Open Framework Compounds (MOF2014)　2014/09/28

  49. Thermodynamic of Nanoporous Materials: Atomistic Level Description with Applications to Energy Storage. International-presentation

    Rodion V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Y. Bozhko, V. R. Belosludov, Y. Kawazoe

    International Conference "Science of the Future"　2014/09/17

  50. Theoretical Aspects of Atomistic Level Description of Nanoporous Materials. International-presentation Invited

    Rodion V. Belosludov

    International Workshop on Transition Metal Clusters (IWTMC-IV)　2014/09/08

  51. Computational Modelling of Thermodynamic Properties of Nanoporous Materials toward Gas Storage and Separation. International-presentation

    Rodion V. Belosludov, O. S. Subbotin, V.R. Belosludov, Y. Kawazoe

    XXVIIUPAP Conference on Computational Physics , XXVIIUPAP Conference on Computational Physics (CCP2014)　2014/08/11

  52. Thermodynamic Properties of Clathrate Hydrates as Gas Storage and Separation Media: Theoretical Aspects International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    Natural Gas Hydrate Systems Gordon Research Conference　2014/03/23

  53. Theoretical Aspects in Realization of Effective Gas Storage and Separation Media based of Gas Hydrates International-presentation

    Rodion V. Belosludov, R. V. Belosludov, O. S. Subbotin, R. K. Zhdanov, Yu. Yu. Bozhko, K. V. Gets, Y. Kawazoe, V. R. Belosludov

    Natural Gas Hydrate Systems Gordon Research Conference　2014/03/23

  54. Theoretical Study of Nanoporous Gas Storage Materials based on Clathrate Hydrates. International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, Y. Kawazoe, V. R. Belosludov

    13th International Conference on the Physics and Chemistry of Ice　2014/03/17

  55. Theoretical Study of Nanoporous Materials for Gas Storage and Separation. International-presentation

    Rodion V. Belosludov, H. Mizuseki, Y. Kawazoe

    MRS Fall Meeting　2013/12/01

  56. Theoretical Study on Zr - Cu - Al Metallic Glasses International-presentation

    Rodion V. Belosludov, Y. Yokoyama, D. V. Louzguine-Luzgin

    The 8th General Meeting of Asian Consortium on Computational Materials Science (ACCMS-VO7)　2013/11/07

  57. Structural, Dynamic and Thermodynamic Properties of ZR-CU-AL Metallic Glasses: Theoretical Aspects International-presentation

    Rodion V. Belosludov, Y. Yokoyama, D. V. Louzguine-Luzgin

    Amorphous and Nanostructured Magnetic Materials (ANMM2013)　2013/10/01

  58. Computational model for gas storage in clathrate hydrates. International-presentation

    Rodion V. Belosludov, O.S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    EUROMAT 2013　2013/09/08

  59. First-principles Study of Metal-Organic Framework Materials for selective Molecular Separation: The Role of Host-Guest Interactions. International-presentation

    Rodion V. Belosludov, H. Mizuseki, Y. Kawazoe

    EUROMAT 2013　2013/09/08

  60. Catalytic activity of nano-sized TiO2 partciles toward decomposition of ammonium perchlorate. International-presentation

    Rodion V. Belosludov, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    EuropaCat 2013　2013/09/01

  61. Description of Properties of Gas Hydrates using interaction potentials evaluated from TOMBO program International-presentation Invited

    Rodion V. Belosludov, H. Mizuseki, O. S Subbotin, V. Belosludov, Y. Kawazoe

    TOMBO 20th Anniversary and Russian Megagrant Opening Conference　2013/08/21

  62. Modeling of Composition and Formation Conditions of Binary Hydrates with Methane and Carbon Dioxide

    Rodion V. Belosludov, H. Mizuseki, O. Subbotin, V. Belosludov, Y. Kawazoe, T. Nakamura

    ナノ学会　2013/06/06

  63. Theoretical study of nanoporous materials with weak guest-host interactions

    Rodion V. Belosludov, H. Mizuseki, O. S. Subbotin, V. R. Belosludov, Y. Kawazoe

    ナノ学会　2013/06/06

  64. Theoretical Study of Nanoporous Materials to Gas Storage Applications Invited

    Rodion V. Belosludov

    金属材料研究所125回講 演会　2013/05/22

  65. Atomistic Level Description of Phase Diagram of Gas Clathrate Hydrates with Complex Gas Compositions International-presentation

    Rodion V. Belosludov, H. Mizuseki, O. Subbotin, V. Belosludov, Y. Kawazoe

    APS March Meeting 2013　2013/03/18

  66. Atomistic Level Description of Molecular/Atom Nano-structures Deposited on Si Surface International-presentation Invited

    Rodion V. Belosludov

    Japan-Russia CVD Seminar　2013/03/09

  67. Molecular Level Description of Physical and Chemical Properties of Nanoporous Materials with Applications to Energy Storage International-presentation Invited

    Rodion V. Belosludov

    EMN Fall Meeting　2012/11/29

  68. Theoretical Aspects of Gas Storage in Clathrate Hydrates for Realization sustainable Future. International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2012/11/25

  69. Atomic Level Description of Glass Transition Behaviour of Zr-Cu-Al: Structural, Dynamic and Thermodynamic Properties International-presentation

    Rodion V. Belosludov, Y. Yokoyama, D. V. Louzguine-Luzgin, H. Mizuseki, Y. Kawazoe, A. Inoue

    MRS Fall Meeting　2012/11/25

  70. Atomistic level description of Ni amorphous solid International-presentation

    Rodion V. Belosludov, D. V. Louzguine-Luzgin, A. Inoue, H. Mizuseki, Y. Kawazoe

    The 7th General Meeting of Asian Consortium on Computational Materials Science (ACCMS-VO7)　2012/11/23

  71. Realization of Gas Storage Materials based on Clathrate Hydrate: Computational Modelling International-presentation

    Rodion V. Belosludov, H. Mizuseki, O. S Subbotin, V. Belosludov, Y. Kawazoe

    Conference on Computational Physics 2012 (CCP2012)　2012/10/14

  72. Theoretical study of electronic and transport properties of atomic nanowires deposited on silicon surface

    Rodion V. Belosludov

    ナノ学会　2012/06/13

  73. Structural, Dynamic and Thermodynamic Properties of Ni during the Cooling Process

    Rodion V. Belosludov, H. Mizuseki, Y. Kawazoe, D. V. Louzguine-Luzhgin, A. Inoue

    日本金属学会　2012/03/28

  74. Theoretical aspects of gas storage in clathrate hydrates: lattice dynamics and first-principles calculations International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    Natural Gas Hydrate Systems Gordon Research Conference　2012/03/18

  75. Capping Ligand Protection of Core/Shell Quantum Dots: Theoretical Study International-presentation

    Rodion V. Belosludov, H. Mizuseki, A. Kasuya, Y. Kawazoe

    MRS Fall Meeting　2011/11/28

  76. Design of Metal-Organic Framework Materials for Selective Gas and Drug Separation: The Role of Host-Guest Interaction International-presentation

    Rodion V. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe

    The 6th Conference of the Asian Consortium on Computational Materials Science (ACCMS-6)　2011/09/06

  77. Theoretical Modeling of Phase Diagram of Clathrate Hydrates toward Hydrogen Storage Applications International-presentation

    Rodion V. Belosludov, H. Mizuseki, O. S. Subbotin, V. R. Belosludov, Y. Kawazoe

    Nanotech 2011－TechConnect WORLD Conference & Expo 2011　2011/07/13

  78. Theoretical Study of Quantum Dots/Organic Ligands Interface International-presentation

    Rodion V. Belosludov, H. Mizuseki, A. Kasuya, Y. Kawazoe

    The 9th International Conference on Nano-Molecular Electronics　2010/12/14

  79. The Role of Host-Guest Interaction in design of Metal-Organic Framework Materilas for Selectve Gas and Drug Separation: Theoretical Aspects International-presentation

    Rodion V. Belosludov

    MRS Fall Meeting　2010/11/29

  80. An Atomistic Level Description of Properties of Complex Materials International-presentation Invited

    Rodion V. Belosludov

    Novosibirsk-Tohoku Global COE Conference for young scientists “New processes for syntheses of multifunctional multicomponent materials”　2010/09/21

  81. Computer Simulation of Methane-Helium Gas Mixture Separation at Gas Hydrate Formation International-presentation

    Rodion V. Belosludov, O. S. Subbotin, Yu. Yu. Bozhko, V. R. Belosludov, H. Mizuseki, Y. Kawazoe

    12th International Conference on the Physics and Chemistry of Ice　2010/09/05

  82. Properties of Amorphous Solid Ice and the Polyamorphism Transformation under Pressure: Theoretical Aspects International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, Y. Kawazoe, V. R. Belosludov

    12th International Conference on the Physics and Chemistry of Ice　2010/09/05

  83. Theoretical Aspects of Hydrogen storage in Clathrate Hydrates International-presentation

    O. S. Subbotin, H. Mizuseki, Y. Kawazoe, V. R. Belosludov

    12th International Conference on the Physics and Chemistry of Ice　2010/09/05

  84. Atomistic Level Description of Quantum Dots/Organic Ligands Interface by Ab Initio Calculations International-presentation

    Rodion V. Belosludov, H. Mizuseki, A. Kasuya, Y. Kawazoe

    240th ACS National Meeting　2010/08/22

  85. Hydrogen Storage in Clathrate Hydrate: Molecular Level Description of Thermodynamics Propeties International-presentation

    O. Subbotin, H. Mizuseki, V. Belosludov, Y. Kawazoe

    Renewable Energy 2010 International Conference　2010/06/27

  86. Mixed H2-CH4 Hydrates as Materials for Hydrogen Storage International-presentation

    Rodion V. Belosludov, H. Mizuseki, Y. Kawazoe, O. S. Subbotin, V. R. Belosludov

    World Hydrogen Energy Conference 2010　2010/05/16

  87. Metal-Organic Framework Materials for Gas and Drug Separation: Theoretical study International-presentation

    Rodion V. Belosludov

    2010 International Conference on Nanoscience and Nanotechnology　2010/02/22

  88. Theoretical Study of ZnO Nanoparticles: Stable Onion Configurations International-presentation

    Rodion V. Belosludov

    MRS Fall Meeting　2009/11/30

  89. Theoretical Study of Transport Properties in One-dimension Nanosystems for Application in Molecular Electronics International-presentation Invited

    Russian-Japanese Workshop (Review Conference): State of Materials Research and New Trends in Material Science　2009/08/03

  90. Metal-Organic Framework Materials for Stereo-Selective Separation: Theoretical Study International-presentation

    Rodion V. Belosludov

    3rd International Conference of Nanobiotechnology & Nanomedicine　2009/06/22

  91. An Atomistic Level Description of the Quantum Dot Organic Ligand Interface

    Rodion V. Belosludov, 水関 博志, 川添 良幸

    日本金属学会　2009/03/28

  92. Theoretical study of the Quantum Dots/Organic Ligands Interface for Application in Early Cancer Detection International-presentation

    The 6th International Conference on Biomedical Applications of Nanotechnology　2009/03/04

  93. Theoretical study on Transport Properties of One-dimension Nanosystems International-presentation

    The 8th International Conference on Nano-Molecular Electronics　2008/12/16

  94. Ab initio Study on the Quantum Dot Organic Ligand Interface: Effect of Core Structure on Cytotoxicity International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    The 5th International Congress of NanoBio & Cleantech 2008　2008/10/26

  95. Accurate Description of Guest-Guest and Guest-Host Interactions in Hydrogen Clathrate: Role of Help Gas on Stability of Water Hydrate Framework International-presentation

    Rodion V. Belosludov

    6th International Conference on Gas Hydrates　2008/07/06

  96. Ab initio Description of the Quantum Dot with Novel Core structure and their Interaction with Organic Ligand International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    Particles 2008　2008/05/10

  97. Transport Properties of One-Dimension Nanosystems for Application in Molecular Electronics International-presentation

    H. Mizuseki, V. Kumar, A. Kasuya, Y. Kawazoe

    2008 International Conference on Nanoscience and Nanotechnology　2008/02/25

  98. Physical and Chemical Properties of Hydrogen Clathrate Hydrate: Theoretical Aspects of Energy Storage Application International-presentation

    Rodion V. Belosludov

    MRS Fall Meeting　2007/11/26

  99. An atomistic level description of the Quantum Dot Organic Ligand Interface by Ab initio Calculations: Effect of Core Structure on Cytotoxicity International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    MRS Fall Meeting　2007/11/26

  100. Transport Properties of Doped Carbon Nanotubes: Effect of Organic Molecules Encapsulation International-presentation

    Rodion V. Belosludov

    MRS Fall Meeting　2007/11/26

  101. Ab initio Description of Quantum Dots/Organic Ligands Interface: Effect of Core Structure on Cyclotoxicity International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    The 4th Conference of the Asian Consortium on Computational Materials Science (ACCMS-4)　2007/09/12

  102. Transport Properties of Carbon Nanotubes: Doping Effect of Organic Molecules International-presentation

    International Symposium on Theories of Organic/Metal Interfaces (ISTOMI'07)　2007/01/15

  103. Novel Quantum Dots for Early Cancer Diagnostic Applications International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    The 9th International Symposium on Future Medical Engineering Based on Bio-nanotechnology (Tohoku University 21st Century COE Programme), jointly organized with The 19th Bioengineering Conference, 2006 Annual Meeting of BED/JSME　2007/01/07

  104. Accurate Prediction of Adsorption Spectra of Promising Photosensitizers for PDF Application International-presentation

    Rodion V. Belosludov, Y. Kawazoe

    The 9th International Symposium on Future Medical Engineering Based on Bio-nanotechnology (Tohoku University 21st Century COE Programme), jointly organized with The 19th Bioengineering Conference, 2006 Annual Meeting of BED/JSME　2007/01/07

  105. Molecular Doping Effect on Electron and Transport Properties of Carbon Nanotube International-presentation

    Rodion V. Belosludov

    The 7th International Conference on Nano-Molecular Electronics (ICNME2006)　2006/12/13

  106. CdSe-Core Quantum Dots with Novel Structure and Electronics Properties International-presentation

    Rodion V. Belosludov

    MRS Fall Meeting　2006/11/27

  107. Structural, Electronics and Transport Properties of Doped Carbon Nanotube International-presentation

    Rodion V. Belosludov

    International Congress of Nanotechnology (ICNT2006)　2006/10/30

  108. Theoretical Study of Transport in Nano-scale Systems for Molecular Wire Application International-presentation

    Rodion V. Belosludov

    2006 International Conference on Nanoscience and Nanotechnology (ICONN06)　2006/07/03

  109. Electronic and Structural Properties of Novel Quantum Dots for Application to Early Cancer Diagnostics International-presentation

    2006 International Conference on Nanoscience and Nanotechnology (ICONN06)　2006/07/03

  110. Theoretical Study of CdSe-based Nanomaterials for Nanomedicine Application International-presentation

    Rodion V. Belosludov

    2005 MRS Fall Meeting　2005/11/29

  111. Electronic and Structural Properties of Organic Molecules inside Carbon Nanotube International-presentation

    Rodion V. Belosludov

    International Conference on Solid State Devices and Materials (SSDM2005)　2005/09/13

  112. Theoretical Study of Electronic and Transport Properties of Doped Carbon Nanotube

    Rodion V. Belosludov

    第66回応用物理学会学術講演会　2005/09/07

  113. Ab Initio Computer Simulation to Predict New Materials for Nanotechnology International-presentation

    Rodion V. Belosludov

    the 5th International Conference on Intelligent Processing & Manufacturing of Materials (IPMM2005)　2005/07/19

  114. Theoretical Study of Hydrogen Clathrate International-presentation

    Rodion V. Belosludov

    5th International Conference on Gas Hydrates (ICGH2005)　2005/06/12

  115. First-Principles Study on CdSe Nanoclusters for Application in Nanomedicine

    Rodion V. Belosludov

    ナノ学会第3回大会　2005/05/08

  116. Configuration of Organic Molecules Inside Carbon Nanotube: Theoretical Study

    Rodion V. Belosludov

    ナノ学会第3回大会　2005/05/08

  117. First-Principles Study on Atomic and Molecular Wires: Electronic and Transport Properties

    Rodion V. Belosludov

    ナノ学会第3回大会　2005/05/08

  118. 第一原理計算による分子被覆導線のドーピング効果の検討

    Rodion V. Belosludov

    第52回応用物理学関係連合講演会　2005/03/29

  119. ??????????????????????????

    Rodion V. Belosludov

    ?52?????????????　2005/03/29

  120. First-Principles Nanomaterial Design for Application in Nanomedicine

    Rodion V. Belosludov

    21st Century COE Program　2005/02/15

  121. Electronic and transport properties of molecular wires International-presentation

    Rodion V. Belosludov

    International Conference on Solid State Devices and Materials　2004/09/15

  122. Realization of molecular and atomic interconnection for molecular electronics International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    Second Conference of Asian Consortium for Computational Materials Science　2004/07/14

  123. "Molecular enamel wire”- interconnects for molecular electronics: theoretical study International-presentation Invited

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    International Workshop on Smart Interconnects (IWSI)　2003/11/06

  124. Energetic and electronics structures of organics/carbon nanotube compounds

    Rodion V. Belosludov, Y. Kawazoe

    第25回フラーレン・ナノチューブ総合シンポジウム　2003/07/23

  125. Theoretical study of molecular enamel wire for molecular electronics International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    2003 TMS Electronic Materials Conference　2003/06/25

  126. Clathrate hydrates with multiple occupations: theoretical study International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    The 4th International Conference on Intelligent Processing and Manufacturing of Materials, IPMM 03　2003/05/18

  127. Electronic structure of self-localized excitons in one dimensional C60 crystal International-presentation

    Rodion V. Belosludov, T. M. Inerbaev, Y. Kawazoe, V. R. Belosludov

    The 4th International Conference on Intelligent Processing and Manufacturing of Materials, IPMM 03　2003/05/18

  128. Realization of molecular enamel wire concept for molecular electronics International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    The 4th International Conference on Intelligent Processing and Manufacturing of Materials, IPMM 03　2003/05/18

  129. Theoretical Study of Single Conducting Molecular Wire Covered by Molecular Nanotube: Application in Molecular Electronics International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    MRS Spring Meeting 2003　2003/04/21

  130. Theoretical Evidence of Cage-like CdSe Clusters

    Rodion V. Belosludov, H. Mizuseki, A. Kasuya, Y. Kawazoe

    第24回フラーレン・ナノチューブ総合シンポジウム　2003/01/08

  131. Molecular enamel wires for electronic device: theoretical study International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    International Conference on Solid State Devices and Materials　2002/09/17

  132. Theoretical study on inclusion complex of polyaniline covered by cyclodextrins for molecular device International-presentation

    Rodion V. Belosludov, A. A. Farajian, H. Mizuseki, Y. Kawazoe

    International Conference on Solid State Devices and Materials　2001/09/26

  133. Lattice dynamics simulations of resonant scattering of lattice phonons of clathrate compounds by guests atoms International-presentation

    Rodion V. Belosludov, O. S. Subbotin, H. Mizuseki, V. R. Belosludov, Y. Kawazoe

    The 3rd International Conference on Intelligent Processing and Manufacturing of Materials, IPMM 01　2001/07/29

  134. Density Functional Study of Electronic Properties of Co Doped SrTiO3

    Rodion V. Belosludov, M. Kubo, S. Takami, A. Miyamoto

    第48回応用物理学関係連合講演会　2001/03/28

  135. Combinatorial Computational approach as a promising Method for Design of New Catalysts based on TiO2 International-presentation

    Rodion V. Belosludov, M. Kubo, S. Takami, A. Miyamoto

    International Symposium on Molecular Design of Catalysts　2000/08/22

  136. Theoretical study on transition metal clusters: application in heterogeneous catalysis International-presentation

    Rodion V. Belosludov, M. Kubo, S. Takami, A. Miyamoto

    International Workshop on Materials Design by Computer simulation at Atomic and Electron Levels　2000/08/18

Show all Show first 5

Teaching Experience 12

  1. 計算材料学　学部／研究科：工学研究科

  2. 計算材料学　学部／研究科：工学研究科

  3. 計算材料学　学部／研究科：工学研究科

  4. 計算材料学　学部／研究科：工学研究科

  5. 計算材料学　学部／研究科：工学研究科

  6. 計算材料学　学部／研究科：工学研究科

  7. 計算材料学　学部／研究科：工学研究科

  8. 計算材料学　学部／研究科：工学研究科

  9. 計算材料学　学部／研究科：工学研究科

  10. 計算材料学　学部／研究科：工学研究科

  11. 計算材料学　学部／研究科：工学研究科

  12. 計算材料学　学部／研究科：工学研究科

Show all Show first 5

Media Coverage 4

  1. アセチレン 新物質で安全輸送 京大など開発 分子の衝突防止

    日経産業新聞

    2005/08/02

    Type: Newspaper, magazine

  2. 高爆発性のアセチレンガス 選択的に安定、高密度濃縮 北川・京大教授らのグループ成功

    科学新聞

    2005/07/22

    Type: Newspaper, magazine

  3. アセチレンを超高密度濃縮 京大などが多孔材料開発

    日刊工業新聞

    2005/07/14

    Type: Newspaper, magazine

  4. 日本の共同研究チーム、ナノポーラス金属錯体を用いて安全に高濃度アセチレン吸着、さらにメカニズムを解析

    日経ナノテクノロジー Plus

    2005/07/14

    Type: Newspaper, magazine

Other 2

  1. エネルギー・環境問題を目指したガスハイドレート相図作成手法の確立

    More details Close

    各種ハイドレート相が存在可能な温度、圧力領域をシミュレーションで予測し、エネルギー資源の確保と温室効果ガス削減に貢献する。

  2. クラスレートハイドレートを用いた新規温室効果ガス貯留材料の原子レベル記述

    More details Close

    複雑なゲスト成分のクラスレートハイドレートの形成、安定性の熱力学的条件を決定し、温室効果ガス(GHG)の貯蔵用媒体としてのガスハイドレートの可能性を検証する。広範囲の圧力−温度領域にわたり、異なる構造を持つ各種の氷、ハイドレートの構造、力学、熱力学的性質算定のために、我々独自開発した原子レベルに基づく理論モデルによるシミュレーション計算を行った。ハイドレート相中への温室効果ガスの高密度な貯蔵を目的として、ゲスト分子が及ぼす異なるハイドレート構造のホスト格子への影響を検証する。温室効果ガスクラスレートハイドレートの自己保存効果が利用可能なのかも同時に検証する。提案している計算アプローチにより得られた結果は、クラスレートハイドレート基の温室効果ガス貯蔵材料の実用化に寄与出来る重要な情報である。