The inhomogeneous structure of water at ambient conditions C Huang, KT Wikfeldt, T Tokushima, D Nordlund, Y Harada, U Bergmann, ... Proceedings of the National Academy of Sciences 106 (36), 15214-15218, 2009 | 702 | 2009 |
Relevance of weak hydrogen bonds in the conformation of organic compounds and bioconjugates: evidence from recent experimental data and high-level ab initio MO calculations O Takahashi, Y Kohno, M Nishio Chemical reviews 110 (10), 6049-6076, 2010 | 601 | 2010 |
High resolution X-ray emission spectroscopy of liquid water: The observation of two structural motifs T Tokushima, Y Harada, O Takahashi, Y Senba, H Ohashi, ... Chemical Physics Letters 460 (4-6), 387-400, 2008 | 477 | 2008 |
Hydrogen-bond-like nature of the CH/π interaction as evidenced by crystallographic database analyses and ab initio molecular orbital calculations O Takahashi, Y Kohno, S Iwasaki, K Saito, M Iwaoka, S Tomoda, ... Bulletin of the Chemical Society of Japan 74 (12), 2421-2430, 2001 | 178 | 2001 |
Functional dependence of core-excitation energies O Takahashi, LGM Pettersson The Journal of chemical physics 121 (21), 10339-10345, 2004 | 169 | 2004 |
Probing the electron delocalization in liquid water and ice at attosecond time scales D Nordlund, H Ogasawara, H Bluhm, O Takahashi, M Odelius, ... Physical Review Letters 99 (21), 217406, 2007 | 146 | 2007 |
High resolution X-ray emission spectroscopy of water and its assignment based on two structural motifs T Tokushima, Y Harada, Y Horikawa, O Takahashi, Y Senba, H Ohashi, ... Journal of Electron Spectroscopy and Related Phenomena 177 (2-3), 192-205, 2010 | 132 | 2010 |
Selective probing of the OH or OD stretch vibration in liquid water using resonant inelastic soft-X-ray scattering Y Harada, T Tokushima, Y Horikawa, O Takahashi, H Niwa, M Kobayashi, ... Physical Review Letters 111 (19), 193001, 2013 | 128 | 2013 |
Molecularly intact and dissociative adsorption of water on clean Cu (1 1 0): A comparison with the water/Ru (0 0 1) system K Andersson, A Gómez, C Glover, D Nordlund, H Öström, T Schiros, ... Surface Science 585 (3), L183-L189, 2005 | 113 | 2005 |
Dynamics of hollow atom formation in intense X-ray pulses probed by partial covariance mapping LJ Frasinski, V Zhaunerchyk, M Mucke, RJ Squibb, M Siano, JHD Eland, ... Physical review letters 111 (7), 073002, 2013 | 104 | 2013 |
Basis set superposition error free self-consistent field method for molecular interaction in multi-component systems: Projection operator formalism T Nagata, O Takahashi, K Saito, S Iwata The Journal of Chemical Physics 115 (8), 3553-3560, 2001 | 104 | 2001 |
Structure of water adsorbed on the open Cu (1 1 0) surface: H-up, H-down, or both? T Schiros, S Haq, H Ogasawara, O Takahashi, H Öström, K Andersson, ... Chemical Physics Letters 429 (4-6), 415-419, 2006 | 102 | 2006 |
Molecular orbital calculations of the substituent effect on intermolecular CH/π interaction in C2H3X–C6H6 complexes (X= H, F, Cl, Br, and OH) O Takahashi, Y Kohno, K Saito Chemical physics letters 378 (5-6), 509-515, 2003 | 87 | 2003 |
Detailed chemical kinetic mechanisms of ethyl methyl, methyl tert-butyl and ethyl tert-butyl ethers: The importance of uni-molecular elimination reactions K Yasunaga, JM Simmie, HJ Curran, T Koike, O Takahashi, Y Kuraguchi, ... Combustion and Flame 158 (6), 1032-1036, 2011 | 85 | 2011 |
Selective observation of the two oxygen atoms at different sites in the carboxyl group (–COOH) of liquid acetic acid T Tokushima, Y Horikawa, Y Harada, O Takahashi, A Hiraya, S Shin Physical Chemistry Chemical Physics 11 (11), 1679-1682, 2009 | 76 | 2009 |
Unimolecular decomposition of formic acid in the gas phase on the ratio of the competing reaction channels K Saito, T Shiose, O Takahashi, Y Hidaka, F Aiba, K Tabayashi The Journal of Physical Chemistry A 109 (24), 5352-5357, 2005 | 63 | 2005 |
The anomeric effect revisited. A possible role of the CH/n hydrogen bond O Takahashi, K Yamasaki, Y Kohno, R Ohtaki, K Ueda, H Suezawa, ... Carbohydrate research 342 (9), 1202-1209, 2007 | 62 | 2007 |
Polarization dependent resonant x-ray emission spectroscopy of D2O and H2O water: Assignment of the local molecular orbital symmetry T Tokushima, Y Horikawa, H Arai, Y Harada, O Takahashi, ... The Journal of Chemical Physics 136 (4), 2012 | 56 | 2012 |
Investigation of organoiron catalysis in Kumada–Tamao–Corriu-type cross-coupling reaction assisted by solution-phase X-ray absorption spectroscopy H Takaya, S Nakajima, N Nakagawa, K Isozaki, T Iwamoto, R Imayoshi, ... Bulletin of the Chemical Society of Japan 88 (3), 410-418, 2015 | 52 | 2015 |
Shock tube and modeling study of isobutene pyrolysis and oxidation K Yasunaga, Y Kuraguchi, R Ikeuchi, H Masaoka, O Takahashi, T Koike, ... Proceedings of the Combustion Institute 32 (1), 453-460, 2009 | 51 | 2009 |