Osamu Sugino
Osamu Sugino
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First-principles calculations of charged surfaces and interfaces: A plane-wave nonrepeated slab approach
M Otani, O Sugino
Physical Review B—Condensed Matter and Materials Physics 73 (11), 115407, 2006
First-principles study on energetics of c-BN (001) reconstructed surfaces
J Yamauchi, M Tsukada, S Watanabe, O Sugino
Physical Review B 54 (8), 5586, 1996
Dirac fermions in borophene
B Feng, O Sugino, RY Liu, J Zhang, R Yukawa, M Kawamura, T Iimori, ...
Physical review letters 118 (9), 096401, 2017
Experimental realization of two-dimensional Dirac nodal line fermions in monolayer Cu2Si
B Feng, B Fu, S Kasamatsu, S Ito, P Cheng, CC Liu, Y Feng, S Wu, ...
Nature communications 8 (1), 1007, 2017
Graphitic ribbons without hydrogen-termination: Electronic structures and stabilities
T Kawai, Y Miyamoto, O Sugino, Y Koga
Physical Review B 62 (24), R16349, 2000
Vacancy in Si: Successful description within the local-density approximation
O Sugino, A Oshiyama
Physical review letters 68 (12), 1858, 1992
Ab initio molecular dynamics study of first-order phase transitions: melting of silicon
O Sugino, R Car
Physical review letters 74 (10), 1823, 1995
Density-functional approach to electron dynamics: Stable simulation under a self-consistent field
O Sugino, Y Miyamoto
Physical Review B 59 (4), 2579, 1999
First-principles molecular dynamics at a constant electrode potential
N Bonnet, T Morishita, O Sugino, M Otani
Physical Review Letters 109 (26), 266101, 2012
Electrode dynamics from first principles
M Otani, I Hamada, O Sugino, Y Morikawa, Y Okamoto, T Ikeshoji
Journal of the Physical Society of Japan 77 (2), 024802, 2008
Completing density functional theory by machine learning hidden messages from molecules
R Nagai, R Akashi, O Sugino
npj Computational Materials 6 (1), 43, 2020
Structure of the water/platinum interface––a first principles simulation under bias potential
M Otani, I Hamada, O Sugino, Y Morikawa, Y Okamoto, T Ikeshoji
Physical Chemistry Chemical Physics 10 (25), 3609-3612, 2008
Roadmap on machine learning in electronic structure
HJ Kulik, T Hammerschmidt, J Schmidt, S Botti, MAL Marques, M Boley, ...
Electronic Structure 4 (2), 023004, 2022
Nonadiabatic couplings from time-dependent density functional theory: Formulation in the Casida formalism and practical scheme within modified linear response
C Hu, H Hirai, O Sugino
The Journal of chemical physics 127 (6), 2007
First-principles molecular dynamics simulation of biased electrode/solution interface
O Sugino, I Hamada, M Otani, Y Morikawa, T Ikeshoji, Y Okamoto
Surface Science 601 (22), 5237-5240, 2007
Discovery of 2D anisotropic Dirac cones
B Feng, J Zhang, S Ito, M Arita, C Cheng, L Chen, K Wu, F Komori, ...
Advanced Materials 30 (2), 1704025, 2018
Green’s function method for elimination of the spurious multipole interaction in the surface/interface slab model
I Hamada, M Otani, O Sugino, Y Morikawa
Physical Review B—Condensed Matter and Materials Physics 80 (16), 165411, 2009
Microscopic mechanism of atomic diffusion in Si under pressure
O Sugino, A Oshiyama
Physical Review B 46 (19), 12335, 1992
Comparative study of dehydrogenation of methanol at Pt (1 1 1)/water and Pt (1 1 1)/vacuum interfaces
Y Okamoto, O Sugino, Y Mochizuki, T Ikeshoji, Y Morikawa
Chemical physics letters 377 (1-2), 236-242, 2003
Improved modeling of electrified interfaces using the effective screening medium method
I Hamada, O Sugino, N Bonnet, M Otani
Physical Review B—Condensed Matter and Materials Physics 88 (15), 155427, 2013
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