Experimental evidence for epitaxial silicene on diboride thin films A Fleurence, R Friedlein, T Ozaki, H Kawai, Y Wang, ... Physical review letters 108 (24), 245501, 2012 | 1736 | 2012 |
Variationally optimized atomic orbitals for large-scale electronic structures T Ozaki Physical Review B 67 (15), 155108, 2003 | 1355 | 2003 |
Reproducibility in density functional theory calculations of solids K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ... Science 351 (6280), aad3000, 2016 | 1281 | 2016 |
Numerical atomic basis orbitals from H to Kr T Ozaki, H Kino Physical Review B 69 (19), 195113, 2004 | 1067 | 2004 |
Efficient projector expansion for the ab initio LCAO method T Ozaki, H Kino Physical Review B—Condensed Matter and Materials Physics 72 (4), 045121, 2005 | 491 | 2005 |
Stiffness of single-walled carbon nanotubes under large strain T Ozaki, Y Iwasa, T Mitani Physical review letters 84 (8), 1712, 2000 | 267 | 2000 |
Efficient implementation of the nonequilibrium Green function method for electronic transport calculations T Ozaki, K Nishio, H Kino Physical Review B—Condensed Matter and Materials Physics 81 (3), 035116, 2010 | 250 | 2010 |
First-principles calculation of the electronic properties of graphene clusters doped with nitrogen and boron: analysis of catalytic activity for the oxygen reduction reaction SF Huang, K Terakura, T Ozaki, T Ikeda, M Boero, M Oshima, J Ozaki, ... Physical Review B—Condensed Matter and Materials Physics 80 (23), 235410, 2009 | 227 | 2009 |
Continued fraction representation of the Fermi-Dirac function for large-scale electronic structure calculations T Ozaki Physical Review B—Condensed Matter and Materials Physics 75 (3), 035123, 2007 | 194 | 2007 |
electronic structure calculation method based on the nonorthogonal pseudoatomic orbital basis MJ Han, T Ozaki, J Yu Physical Review B—Condensed Matter and Materials Physics 73 (4), 045110, 2006 | 194 | 2006 |
Anisotropic exchange interactions of spin-orbit-integrated states in H Jin, H Jeong, T Ozaki, J Yu Physical Review B—Condensed Matter and Materials Physics 80 (7), 075112, 2009 | 155 | 2009 |
Dual spin filter effect in a zigzag graphene nanoribbon T Ozaki, K Nishio, H Weng, H Kino Physical Review B—Condensed Matter and Materials Physics 81 (7), 075422, 2010 | 148 | 2010 |
Krylov-subspace method for large-scale ab initio electronic structure calculations T Ozaki Physical Review B—Condensed Matter and Materials Physics 74 (24), 245101, 2006 | 123 | 2006 |
Magnetic ordering and exchange interactions in multiferroic MJ Han, T Ozaki, J Yu Physical Review B—Condensed Matter and Materials Physics 75 (6), 060404, 2007 | 101 | 2007 |
Unfolding method for first-principles LCAO electronic structure calculations CC Lee, Y Yamada-Takamura, T Ozaki Journal of Physics: Condensed Matter 25 (34), 345501, 2013 | 92 | 2013 |
Revisiting magnetic coupling in transition-metal-benzene complexes with maximally localized Wannier functions H Weng, T Ozaki, K Terakura Physical Review B—Condensed Matter and Materials Physics 79 (23), 235118, 2009 | 92 | 2009 |
Systematic study of electronic and magnetic properties for Cu12–xTMxSb4S13 (TM= Mn, Fe, Co, Ni, and Zn) tetrahedrite K Suekuni, Y Tomizawa, T Ozaki, M Koyano Journal of Applied Physics 115 (14), 2014 | 89 | 2014 |
Electronic structure, magnetic interactions, and the role of ligands in single-molecule magnets MJ Han, T Ozaki, J Yu Physical Review B—Condensed Matter and Materials Physics 70 (18), 184421, 2004 | 85 | 2004 |
Electronic structures of Pt clusters adsorbed on (5, 5) single wall carbon nanotube DH Chi, NT Cuong, NA Tuan, YT Kim, HT Bao, T Mitani, T Ozaki, H Nagao Chemical Physics Letters 432 (1-3), 213-217, 2006 | 84 | 2006 |
Contact-structure dependence of transport properties of a single organic molecule between Au electrodes H Kondo, H Kino, J Nara, T Ozaki, T Ohno Physical Review B—Condensed Matter and Materials Physics 73 (23), 235323, 2006 | 78 | 2006 |