| Emergence of the Dirac electron system in a single-component molecular conductor under high pressure R Kato, HB Cui, T Tsumuraya, T Miyazaki, Y Suzumura Journal of the American Chemical Society 139 (5), 1770-1773, 2017 | 62 | 2017 |
| Cation Dependence of the Electronic States in Molecular Triangular Lattice System β′-X[Pd(dmit)2]2: A First-Principles Study T Tsumuraya, H Seo, M Tsuchiizu, R Kato, T Miyazaki Journal of the Physical Society of Japan 82 (3), 033709, 2013 | 40 | 2013 |
| First-principles study on lithium and magnesium nitrogen hydrides for hydrogen storage T Tsumuraya, T Shishidou, T Oguchi Journal of alloys and compounds 446, 323-327, 2007 | 40 | 2007 |
| Hydrogen-induced modification of the electronic structure and magnetic states in Fe, Co, and Ni monohydrides N Ishimatsu, T Shichijo, Y Matsushima, H Maruyama, Y Matsuura, ... Physical Review B—Condensed Matter and Materials Physics 86 (10), 104430, 2012 | 38 | 2012 |
| Ambient-pressure Dirac electron system in the quasi-two-dimensional molecular conductor S Kitou, T Tsumuraya, H Sawahata, F Ishii, K Hiraki, T Nakamura, ... Physical Review B 103 (3), 035135, 2021 | 35 | 2021 |
| Theoretical analysis of x-ray absorption spectra of Ti compounds used as catalysts in lithium amide/imide reactions T Tsumuraya, T Shishidou, T Oguchi Physical Review B—Condensed Matter and Materials Physics 77 (23), 235114, 2008 | 34 | 2008 |
| First-principles study on the structural and magnetic properties of iron hydride T Tsumuraya, Y Matsuura, T Shishidou, T Oguchi Journal of the Physical Society of Japan 81 (6), 064707, 2012 | 32 | 2012 |
| First-principles study of the effective Hamiltonian for Dirac fermions with spin-orbit coupling in two-dimensional molecular conductor -(BETS) I T Tsumuraya, Y Suzumura The European Physical Journal B 94 (17), 2021 | 25 | 2021 |
| Pressure‐Induced Metallic Conductivity in the Single‐Component Molecular Crystal [Ni(dmit)2] H Cui, T Tsumuraya, T Miyazaki, Y Okano, R Kato European Journal of Inorganic Chemistry 2014 (24), 3837-3840, 2014 | 25 | 2014 |
| Linear optical properties and electronic structures of poly (3-hexylthiophene) and poly (3-hexylselenophene) crystals from first principles T Tsumuraya, JH Song, AJ Freeman Physical Review B—Condensed Matter and Materials Physics 86 (7), 075114, 2012 | 21 | 2012 |
| Large Diamagnetism and Electromagnetic Duality in Two-Dimensional Dirac Electron System S Fujiyama, H Maebashi, N Tajima, T Tsumuraya, HB Cui, M Ogata, ... Physical Review Letters 128 (2), 027201, 2022 | 20 | 2022 |
| Effective Hamiltonian of Topological Nodal Line Semimetal in Single-Component Molecular Conductor [Pd(dddt)2] from First-Principles T Tsumuraya, R Kato, Y Suzumura Journal of the Physical Society of Japan 87 (11), 113701, 2018 | 19 | 2018 |
| Electronic correlation and geometrical frustration in molecular solids: A systematic ab initio study of T Misawa, K Yoshimi, T Tsumuraya Physical Review Research 2 (3), 032072, 2020 | 17 | 2020 |
| First-principles study of hydrogen-bonded molecular conductor -H (Cat-EDT-TTF/ST) T Tsumuraya, H Seo, R Kato, T Miyazaki Phys. Rev. B 92, 035102, 2015 | 16 | 2015 |
| Fragment Model Study of Molecular Multiorbital System X[Pd(dmit)2]2 H Seo, T Tsumuraya, M Tsuchiizu, T Miyazaki, R Kato Journal of the Physical Society of Japan 84 (4), 044716, 2015 | 16 | 2015 |
| Ab initio derivation and exact diagonalization analysis of low-energy effective Hamiltonians for K Yoshimi, T Tsumuraya, T Misawa Physical Review Research 3 (4), 043224, 2021 | 15 | 2021 |
| Ab initio study on the electronic structure and vibration modes of alkali and alkaline-earth amides and alanates T Tsumuraya, T Shishidou, T Oguchi Journal of Physics: Condensed Matter 21 (18), 185501, 2009 | 14 | 2009 |
| Heterospin frustration in a metal-fullerene-bonded semiconductive antiferromagnet Y Shen, M Cui, S Takaishi, H Kawasoko, K Sugimoto, T Tsumuraya, ... Nature Communications 13 (1), 1-9, 2022 | 12 | 2022 |
| Comprehensive Ab Initio Investigation of the Phase Diagram of Quasi-One-Dimensional Molecular Solids K Yoshimi, T Misawa, T Tsumuraya, H Seo Physical Review Letters 131 (3), 036401, 2023 | 11 | 2023 |
| Single-component conductors based on closed-shell Ni and Pt bis (dithiolene) complexes: metallization under high pressure H Hachem, HB Cui, T Tsumuraya, R Kato, O Jeannin, M Fourmigué, ... Journal of Materials Chemistry C 8 (33), 11581-11592, 2020 | 11 | 2020 |
Tsuyoshi MiyazakiMANA-PI/Group Leader, National Institute for Materials ScienceVerified email at nims.go.jp
