First-Principles Determination of the Soft Mode in Cubic K Parlinski, ZQ Li, Y Kawazoe
Physical Review Letters 78 (21), 4063, 1997
3119 1997 Novel electronic and magnetic properties of two‐dimensional transition metal carbides and nitrides M Khazaei, M Arai, T Sasaki, CY Chung, NS Venkataramanan, M Estili, ...
Advanced Functional Materials 23 (17), 2185-2192, 2013
1893 2013 Highly controlled acetylene accommodation in a metal–organic microporous material R Matsuda, R Kitaura, S Kitagawa, Y Kubota, RV Belosludov, ...
Nature 436 (7048), 238-241, 2005
1557 2005 Penta-graphene: A new carbon allotrope S Zhang, J Zhou, Q Wang, X Chen, Y Kawazoe, P Jena
Proceedings of the National Academy of Sciences 112 (8), 2372-2377, 2015
1506 2015 Ferromagnetism in semihydrogenated graphene sheet J Zhou, Q Wang, Q Sun, XS Chen, Y Kawazoe, P Jena
Nano letters 9 (11), 3867-3870, 2009
976 2009 Clustering of Ti on a C60 Surface and Its Effect on Hydrogen Storage Q Sun, Q Wang, P Jena, Y Kawazoe
Journal of the American Chemical Society 127 (42), 14582-14583, 2005
824 2005 Topological node-line semimetal in three-dimensional graphene networks H Weng, Y Liang, Q Xu, R Yu, Z Fang, X Dai, Y Kawazoe
Physical Review B 92 (4), 045108, 2015
809 2015 Ultra-stable nanoparticles of CdSe revealed from mass spectrometry A Kasuya, R Sivamohan, YA Barnakov, IM Dmitruk, T Nirasawa, ...
Nature materials 3 (2), 99-102, 2004
599 2004 First Principles Based Design and Experimental Evidence for a ZnO-Based Ferromagnet<? format?> at Room Temperature MHF Sluiter, Y Kawazoe, P Sharma, A Inoue, AR Raju, C Rout, ...
Physical review letters 94 (18), 187204, 2005
547 2005 Origin of anomalous lattice expansion in oxide nanoparticles S Tsunekawa, K Ishikawa, ZQ Li, Y Kawazoe, A Kasuya
Physical Review Letters 85 (16), 3440, 2000
541 2000 Structures and Phase Transition of a MoS2 Monolayer M Kan, JY Wang, XW Li, SH Zhang, YW Li, Y Kawazoe, Q Sun, P Jena
The Journal of Physical Chemistry C 118 (3), 1515-1522, 2014
537 2014 Vacancy-induced magnetism in ZnO thin films and nanowires Q Wang, Q Sun, G Chen, Y Kawazoe, P Jena
Physical Review B—Condensed Matter and Materials Physics 77 (20), 205411, 2008
494 2008 Metal-encapsulated fullerenelike and cubic caged clusters of silicon V Kumar, Y Kawazoe
Physical Review Letters 87 (4), 045503, 2001
492 2001 Computational materials science: from ab initio to Monte Carlo methods K Ohno, K Esfarjani, Y Kawazoe
Springer, 2018
470 2018 Hysteretic current–voltage characteristics and resistance switching at an epitaxial oxide Schottky junction SrRuO3∕ SrTi0. 99Nb0. 01O3 T Fujii, M Kawasaki, A Sawa, H Akoh, Y Kawazoe, Y Tokura
Applied Physics Letters 86 (1), 2005
470 2005 Low-Temperature Phase Transformation from Graphite to JT Wang, C Chen, Y Kawazoe
Physical review letters 106 (7), 075501, 2011
407 2011 A theoretical study on the interaction of aromatic amino acids with graphene and single walled carbon nanotube C Rajesh, C Majumder, H Mizuseki, Y Kawazoe
The Journal of chemical physics 130 (12), 2009
336 2009 Cluster expansion method for adsorption: Application to hydrogen chemisorption on graphene MHF Sluiter, Y Kawazoe
Physical Review B 68 (8), 085410, 2003
336 2003 Intramolecular structures of T Hashizume, K Motai, XD Wang, H Shinohara, Y Saito, Y Maruyama, ...
Physical review letters 71 (18), 2959, 1993
333 1993 Exfoliating biocompatible ferromagnetic Cr-trihalide monolayers J Liu, Q Sun, Y Kawazoe, P Jena
Physical Chemistry Chemical Physics 18 (13), 8777-8784, 2016
329 2016 