| Theory of ferromagnetic semiconductors H Katayama‐Yoshida, K Sato, T Fukushima, M Toyoda, H Kizaki, VA Dinh, ... physica status solidi (a) 204 (1), 15-32, 2007 | 237 | 2007 |
| Electronic structures of (Zn, TM) O (TM: V, Cr, Mn, Fe, Co, and Ni) in the self-interaction-corrected calculations M Toyoda, H Akai, K Sato, H Katayama-Yoshida Physica B: Condensed Matter 376, 647-650, 2006 | 191 | 2006 |
| Computational nano-materials design for high-TC ferromagnetism in wide-gap magnetic semiconductors H Katayama-Yoshida, K Sato, T Fukushima, M Toyoda, H Kizaki, VA Dinh, ... Journal of Magnetism and Magnetic Materials 310 (2), 2070-2077, 2007 | 83 | 2007 |
| Exchange Interaction and T c in Alkaline-Earth-Metal-Oxide-Based DMS without Magnetic Impurities: First Principle Pseudo-SIC and Monte Carlo Calculation V An Dinh, M Toyoda, K Sato, H Katayama-Yoshida Journal of the Physical Society of Japan 75 (9), 093705, 2006 | 64 | 2006 |
| Curie temperature of GaMnN and GaMnAs from LDA‐SIC electronic structure calculations M Toyoda, H Akai, K Sato, H Katayama‐Yoshida physica status solidi (c) 3 (12), 4155-4159, 2006 | 50 | 2006 |
| Ab initio study of magnetic coupling in CaCuO (, Ge, Zr, and Sn) M Toyoda, K Yamauchi, T Oguchi Physical Review B—Condensed Matter and Materials Physics 87 (22), 224430, 2013 | 44 | 2013 |
| Ab initio study on magnetic coupling in A-site-ordered perovskite CaCu3B4O12 (B= Ti, Ge, Zr, and Sn) M Toyoda, K Yamauchi, T Oguchi APS Meeting Abstracts 1, 17014, 2013 | 44* | 2013 |
| Ab initio materials design for transparent-conducting-oxide-based new-functional materials H Katayama-Yoshida, K Sato, H Kizaki, H Funashima, I Hamada, ... Applied Physics A 89, 19-27, 2007 | 39 | 2007 |
| Fast spherical Bessel transform via fast Fourier transform and recurrence formula M Toyoda, T Ozaki Computer Physics Communications 181 (2), 277-282, 2010 | 23 | 2010 |
| Ab initio study of electronic, magnetic, and spectroscopic properties in A-and B-site-ordered perovskite Ca Cu 3 Fe 2 Sb 2 O 12 H Fujii, M Toyoda, H Momida, M Mizumaki, S Kimura, T Oguchi Physical Review B 90 (1), 014430, 2014 | 19 | 2014 |
| Accurate finite element method for atomic calculations based on density functional theory and Hartree–Fock method T Ozaki, M Toyoda Computer Physics Communications 182 (6), 1245-1252, 2011 | 16 | 2011 |
| First-principles study on electronic structure and spin state of rutile (Ti, Co) O2 by self-interaction-corrected local density approximation: role of oxygen vacancy H Kizaki, M Toyoda, K Sato, H Katayama-Yoshida Applied Physics Express 2 (5), 053004, 2009 | 16 | 2009 |
| Numerical evaluation of electron repulsion integrals for pseudoatomic orbitals and their derivatives M Toyoda, T Ozaki The Journal of chemical physics 130 (12), 124114, 2009 | 16 | 2009 |
| Superexchange interaction in the A-site ordered perovskite YMn 3 Al 4 O 12 M Toyoda, T Saito, K Yamauchi, Y Shimakawa, T Oguchi Physical Review B 92 (1), 014420, 2015 | 15 | 2015 |
| Ferromagnetic Half Metallicity in Doped Chalcopyrite Semiconductors Cu (Al1− xAx) Se2 (A= 3 d Transition-Metal Atoms) M Shahjahan, M Toyoda, T Oguchi Journal of the Physical Society of Japan 83 (9), 094702, 2014 | 15 | 2014 |
| Symmetry-breaking 60°-spin order in the A-site-ordered perovskite LaM n 3 V 4 O 12 T Saito, M Toyoda, C Ritter, S Zhang, T Oguchi, JP Attfield, Y Shimakawa Physical Review B 90 (21), 214405, 2014 | 14 | 2014 |
| Electronic structure and phase transition in polar ScFeO3 from first principles calculations BG Kim, M Toyoda, J Park, T Oguchi Journal of Alloys and Compounds 713, 187-193, 2017 | 12 | 2017 |
| First-principles material design and perspective on semiconductor spintronics materials K Sato, T Fukushima, M Toyoda, H Kizaki, VA Dinh, H Fujii, L Bergqvist, ... Physica B: Condensed Matter 404 (23), 5237-5243, 2009 | 12 | 2009 |
| User’s manual of OpenMX Ver. 3.7 T Ozaki, H Kino, JY SNU, MJ Han, M Ohfuchi, F Ishii, K Sawada, Y Kubota, ... | 8 | 2013 |
| Pseudo‐SIC study on the ferromagnetism induced by carbon in AO‐based DMS (A= Mg, Ca, Ba, Sr) VA Dinh, M Toyoda, K Sato, H Katayama‐Yoshida physica status solidi (c) 3 (12), 4131-4134, 2006 | 8 | 2006 |
Taisuke OzakiProfessor, ISSP, University of TokyoVerified email at issp.u-tokyo.ac.jp
