| A long-range-corrected time-dependent density functional theory Y Tawada, T Tsuneda, S Yanagisawa, T Yanai, K Hirao The Journal of chemical physics 120 (18), 8425-8433, 2004 | 1928 | 2004 |
| An investigation of density functionals: The first-row transition metal dimer calculations S Yanagisawa, T Tsuneda, K Hirao The Journal of Chemical Physics 112 (2), 545-553, 2000 | 246 | 2000 |
| State-selective dissociation of a single water molecule on an ultrathin MgO film HJ Shin, J Jung, K Motobayashi, S Yanagisawa, Y Morikawa, Y Kim, ... Nature materials 9 (5), 442-447, 2010 | 189 | 2010 |
| Density functional theoretical study of pentacene/noble metal interfaces with van der Waals corrections: Vacuum level shifts and electronic structures K Toyoda, I Hamada, K Lee, S Yanagisawa, Y Morikawa The Journal of chemical physics 132 (13), 134703, 2010 | 137 | 2010 |
| Suppressing molecular vibrations in organic semiconductors by inducing strain T Kubo, R Häusermann, J Tsurumi, J Soeda, Y Okada, Y Yamashita, ... Nature communications 7 (1), 11156, 2016 | 106 | 2016 |
| Role of molecular orbitals near the Fermi level in the excitation of vibrational modes of a single molecule at a scanning tunneling microscope junction M Ohara, Y Kim, S Yanagisawa, Y Morikawa, M Kawai Physical review letters 100 (13), 136104, 2008 | 96 | 2008 |
| First-principles study of benzene on noble metal surfaces: Adsorption states and vacuum level shifts K Toyoda, Y Nakano, I Hamada, K Lee, S Yanagisawa, Y Morikawa Surface science 603 (18), 2912-2922, 2009 | 95 | 2009 |
| First-principles study of the pentacene/Cu (1 1 1) interface: adsorption states and vacuum level shifts K Toyoda, Y Nakano, I Hamada, K Lee, S Yanagisawa, Y Morikawa Journal of Electron Spectroscopy and Related Phenomena 174 (1-3), 78-84, 2009 | 59 | 2009 |
| First-principles theoretical study of Alq3/Al interfaces: Origin of the interfacial dipole S Yanagisawa, K Lee, Y Morikawa The Journal of chemical physics 128, 244704, 2008 | 59 | 2008 |
| Impact of the molecular quadrupole moment on ionization energy and electron affinity of organic thin films: Experimental determination of electrostatic potential and electronic … K Yamada, S Yanagisawa, T Koganezawa, K Mase, N Sato, H Yoshida Physical Review B 97 (24), 245206, 2018 | 48 | 2018 |
| Important role of molecular permanent dipoles of the Alq3/Al interface studied from first-principles S Yanagisawa, Y Morikawa Chemical physics letters 420 (4), 523-528, 2006 | 45 | 2006 |
| Intermolecular Interaction as Origin of Red Shifts in Absorption Spectra of Zinc-Phthalocyanine From First-Principles S Yanagisawa, T Yasuda, K Inagaki, Y Morikawa, K Manseki, S Yanagida The Journal of Physical Chemistry A 117 (44), 11246-11253, 2013 | 39 | 2013 |
| HOMO band dispersion of crystalline rubrene: Effects of self-energy corrections within the GW approximation S Yanagisawa, Y Morikawa, A Schindlmayr Physical Review B 88 (11), 115438, 2013 | 39 | 2013 |
| Search for a self-regenerating perovskite catalyst using ab initio thermodynamics calculations S Yanagisawa, A Uozumi, I Hamada, Y Morikawa The Journal of Physical Chemistry C 117 (3), 1278-1286, 2013 | 32 | 2013 |
| Theoretical investigation of adsorption of organic molecules onto Fe (110) surface S Yanagisawa, T Tsuneda, K Hirao, Y Matsuzaki Journal of Molecular Structure: THEOCHEM 716 (1), 45-60, 2005 | 29 | 2005 |
| Density functional theoretical study of perfluoropentacene/noble metal interfaces with van der Waals corrections: adsorption states and vacuum level shifts K Toyoda, I Hamada, K Lee, S Yanagisawa, Y Morikawa The Journal of Physical Chemistry C 115 (13), 5767-5772, 2011 | 28 | 2011 |
| Pseudopotential approximation in van der Waals density functional calculations I Hamada, S Yanagisawa Physical Review B 84 (15), 153104, 2011 | 26 | 2011 |
| Theoretical investigation of the electronic structure of the Alq3/Mg interface S Yanagisawa, Y Morikawa Journal of Physics: Condensed Matter 21 (6), 064247, 2009 | 24 | 2009 |
| Theoretical Investigation on the Electronic Structure of the Alq3/Al Interface S Yanagisawa, Y Morikawa Proc. Int. Symp. Super-Functionality Organic Devices, IPAP Conf. Series 6, 11-14, 2005 | 24* | 2005 |
| Scanning tunneling microscopy/spectroscopy of picene thin films formed on Ag (111) Y Yoshida, HH Yang, HS Huang, SY Guan, S Yanagisawa, T Yokosuka, ... The Journal of Chemical Physics 141 (11), 114701, 2014 | 23 | 2014 |
Yoshitada MorikawaProfessor of Osaka UniversityVerified email at prec.eng.osaka-u.ac.jp
