Lithium diffusion in graphitic carbon K Persson, VA Sethuraman, LJ Hardwick, Y Hinuma, YS Meng, ... The journal of physical chemistry letters 1 (8), 1176-1180, 2010 | 817 | 2010 |
Band structure diagram paths based on crystallography Y Hinuma, G Pizzi, Y Kumagai, F Oba, I Tanaka Computational Materials Science 128, 140-184, 2017 | 602 | 2017 |
Thermodynamic and kinetic properties of the Li-graphite system from first-principles calculations K Persson, Y Hinuma, YS Meng, A Van der Ven, G Ceder Physical Review B 82 (12), 125416, 2010 | 430 | 2010 |
Band alignment of semiconductors from density-functional theory and many-body perturbation theory Y Hinuma, A Grüneis, G Kresse, F Oba Physical Review B 90 (15), 155405, 2014 | 324 | 2014 |
Effect of High Voltage on the Structure and Electrochemistry of LiNi0.5Mn0.5O2: A Joint Experimental and Theoretical Study J Bréger, YS Meng, Y Hinuma, S Kumar, K Kang, Y Shao-Horn, G Ceder, ... Chemistry of Materials 18 (20), 4768-4781, 2006 | 269 | 2006 |
Discovery of earth-abundant nitride semiconductors by computational screening and high-pressure synthesis Y Hinuma, T Hatakeyama, Y Kumagai, LA Burton, H Sato, Y Muraba, ... Nature communications 7 (1), 11962, 2016 | 250 | 2016 |
Ionization potentials of solids: the importance of vertex corrections A Grüneis, G Kresse, Y Hinuma, F Oba Physical review letters 112 (9), 096401, 2014 | 227 | 2014 |
Phase Transitions in the LiNi0.5Mn0.5O2 System with Temperature Y Hinuma, YS Meng, K Kang, G Ceder Chemistry of Materials 19 (7), 1790-1800, 2007 | 199 | 2007 |
Pure H–conduction in oxyhydrides G Kobayashi, Y Hinuma, S Matsuoka, A Watanabe, M Iqbal, M Hirayama, ... Science 351 (6279), 1314-1317, 2016 | 194 | 2016 |
Temperature-concentration phase diagram of from first-principles calculations Y Hinuma, YS Meng, G Ceder Physical Review B 77 (22), 224111, 2008 | 149 | 2008 |
An investigation of the sodium patterning in NaxCoO2 (0.5⩽ x⩽ 1) by density functional theory methods YS Meng, Y Hinuma, G Ceder The Journal of chemical physics 128 (10), 2008 | 130 | 2008 |
Density functional theory calculations of oxygen vacancy formation and subsequent molecular adsorption on oxide surfaces Y Hinuma, T Toyao, T Kamachi, Z Maeno, S Takakusagi, S Furukawa, ... The Journal of Physical Chemistry C 122 (51), 29435-29444, 2018 | 125 | 2018 |
Electronic spin transition in nanosize stoichiometric lithium cobalt oxide D Qian, Y Hinuma, H Chen, LS Du, KJ Carroll, G Ceder, CP Grey, ... Journal of the American Chemical Society 134 (14), 6096-6099, 2012 | 118 | 2012 |
Comparison of approximations in density functional theory calculations: Energetics and structure of binary oxides Y Hinuma, H Hayashi, Y Kumagai, I Tanaka, F Oba Physical Review B 96 (9), 094102, 2017 | 103 | 2017 |
First-Principles Study on Relaxor-Type Ferroelectric Behavior without Chemical Inhomogeneity in BaTaO2N and SrTaO2N Y Hinuma, H Moriwake, YR Zhang, T Motohashi, S Kikkawa, I Tanaka Chemistry of Materials 24 (22), 4343-4349, 2012 | 85 | 2012 |
Ionization potentials of (112) and (11) facet surfaces of CuInSe and CuGaSe Y Hinuma, F Oba, Y Kumagai, I Tanaka Physical Review B 86 (24), 245433, 2012 | 78 | 2012 |
Band alignment of semiconductors and insulators using dielectric-dependent hybrid functionals: Toward high-throughput evaluation Y Hinuma, Y Kumagai, I Tanaka, F Oba Physical Review B 95 (7), 075302, 2017 | 73 | 2017 |
Large-angle illumination STEM: toward three-dimensional atom-by-atom imaging R Ishikawa, AR Lupini, Y Hinuma, SJ Pennycook Ultramicroscopy 151, 122-129, 2015 | 64 | 2015 |
HOMO-band fine structure of OTi- and Pb-phthalocyanine ultrathin films: effects of the electric dipole layer H. Yamane, H. Honda, H. Fukagawa, M. Ohyama, Y. Hinuma, S. Kera, K.K ... Journal of Electron Spectroscopy and Related Phenomena 137, 223-227, 2004 | 62 | 2004 |
Band offsets of CuInSe/CdS and CuInSe/ZnS (110) interfaces: A hybrid density functional theory study Y Hinuma, F Oba, Y Kumagai, I Tanaka Physical Review B 88 (3), 035305, 2013 | 57 | 2013 |