ここからサイトの主なメニューです

成果

ここからページの本文です
2018.07.10
Fine-grained optimization method for crystal structure prediction Kei Terayama, Tomoki Yamashita, Tamio Oguchi and Koji Tsuda npj Computational Materialsvolume 4, Article number: 32 (2018)
2018.07.01
 カー・パリネロ分子動力学(CPMD)ワークショップ 館山佳尚 固体物理 Vol.53/Number 7/ Page 401~406
2018.06.26
Research Update: Ca doping effect on the Li-ion conductivity in NASICON-type solid electrolyte LiZr2(PO4)3: A first-principles molecular dynamics study Yusuke Noda, Koki Nakano, Masanari Otake, Ryo Kobayashi, Masashi Kotobuki, Li Lu and Masanobu Nakayama  APL Materials 6, 060702 (2018)
2018.06.19
High‐Mobility p‐Type and n‐Type Copper Nitride Semiconductors by Direct Nitriding Synthesis and In Silico Doping Design Kosuke Matsuzaki, Kou Harada, Yu Kumagai, Shogo Koshiya, Koji Kimoto,Shigenori Ueda, Masato Sasase, Akihiro Maeda, Tomofumi Susaki, Masaaki Kitano, Fumiyasu Oba and Hideo Hosono Adv. Mater. 2018, 1801968
2018.05.17
Tensile-Strain-Dependent Spin States in Epitaxial LaCoO3Thin Films Y. Yokoyama, Y. Yamasaki, M. Taguchi, Y. Hirata, K. Takubo, J. Miyawaki, Y. Harada, D. Asakura, J. Fujioka, M. Nakamura, H. Daimon, M. Kawasaki, Y. Tokura and H. Wadati Phys. Rev. Lett. 120, 206402
2018.04.26
Intercalation pseudocapacitance of amorphous titanium dioxide@nanoporous graphene for high-rate and large-capacity energy storage Jiuhui Hana, Akihiko Hirata, Jing Du,Yoshikazu Ito, Takeshi Fujita, Shinji Kohara,Toshiaki Ina and Mingwei Chen Nano Energy Volume 49 (2018) Pages 354-362
2018.04.11
Bayesian-Driven First-Principles Calculations for Accelerating Exploration of Fast Ion Conductors for Rechargeable Battery Application Randy Jalem, Kenta Kanamori, Ichiro Takeuchi, Masanobu Nakayama, Hisatsugu Yamasaki and Toshiya Saito Scientific Reportsvolume 8, Article number: 5845 (2018)
2018.03.25
Description of Thermal Vacancies in the CALPHAD Method Taichi Abe, Kiyoshi Hashimoto and Masato Shimono MATERIALS TRANSACTIONS Volume 59 (2018) Issue 4 Pages 580-584 
2018.03.19
Structure prediction of boron-doped graphene by machine learning Thaer M.Dieb, Zhufeng Hou and Koji Tsuda The Journal of Chemical Physics 148, 241716 (2018)
2018.03.07
Quartic Anharmonicity of Rattlers and Its Effect on Lattice Thermal Conductivity of Clathrates from First Principles Terumasa Tadano and Shinji Tsuneyuki Phys. Rev. Lett. 120, 105901
2018.03.01
Unraveling diffraction from glass, liquid, and amorphous materials S. Kohara, Y. Onodera, S. Tahara, 1, A. Masuno, H. Inoue, K. Tsuchiya and O. Sakata NEW GLASS Vol. 33 No. 123 2018 
2018.02.26
Investigation of Structure and Dynamics in Disordered Materials Using Containerless Techniques with In-Situ Quantum Beam and Thermophysical Property Measurements Shinji Kohara, Koji Ohara, Takehiko Ishikawa, Haruka Tamaru and Richard Weber Quantum Beam Sci. 2018 Vol.2/Number 1/Page 5-1~5-24
2018.02.16
Thickness dependence and dimensionality effects on charge and magnetic orderings in La1/3Sr2/3FeO3 thin films K. Yamamoto, Y. Hirata, M. Horio, Y. Yokoyama, K. Takubo, M. Minohara, H. Kumigashira, Y. Yamasaki, H. Nakao, Y. Murakami, A. Fujimori and H. Wadati Phys. Rev. B 97, 075134
2018.02.09
Necessary conditions for superior thermoelectric power of Si/Au artificial superlattice thin-film Yoichi Okamoto, Shin Watanabe, Hisashi Miyazaki and Jun Morimoto Japanese Journal of Applied Physics, Volume 57, Number 3
2018.01.26
First-Principles Lattice Dynamics Method for Strongly Anharmonic Crystals Terumasa Tadano and Shinji Tsuneyuki J. Phys. Soc. Jpn. 87, 041015 (2018) [11 Pages]
2018.01.18
Accelerating the discovery of hidden two-dimensional magnets using machine learning and first principle calculations Itsuki Miyazato, Yuzuru Tanaka and Keisuke Takahashi Journal of Physics: Condensed Matter, Volume 30, Number 6
2018.01.09
Crystal structure prediction accelerated by Bayesian optimization Tomoki Yamashita, Nobuya Sato, Hiori Kino, Takashi Miyake, Koji Tsuda and Tamio Oguchi Phys. Rev. Materials 2, 013803
2018.01.01
Designing a tunable magnet using cluster-assembled iron Keisuke Takahashia Journal of Applied Physics 123, 015102 (2018)

ページの先頭に戻る

ここからサイトの主なメニューです