| 1 |
Second-order Moller-Plesset perturbation theory for the transcorrelated Hamiltonian applied to solid-state calculations
Ochi M, Tsuneyuki S
Chemical Physics Letters, 621, 177, 2015 |
| 2 |
Ab initio molecular dynamics study of the Helmholtz layer formed on solid-liquid interfaces and its capacitance
Ando Y, Gohda Y, Tsuneyuki S
Chemical Physics Letters, 556, 9, 2013 |
| 3 |
Molecular orbital calculation of biomolecules with fragment molecular orbitals
Tsuneyuki S, Kobori T, Akagi K, Sodeyama K, Terakura K, Fukuyama H
Chemical Physics Letters, 476(1-3), 104, 2009 |
| 4 |
Two-Electron Reduction of a Rh-Mo-Rh Dithiolato Complex To Form a Triplet Ground State Associated with a Change in CO Coordination Mode
Muratsugu S, Sodeyama K, Kitamura F, Sugimoto M, Tsuneyuki S, Miyashita S, Kato T, Nishihara H
Journal of the American Chemical Society, 131(4), 1388, 2009 |
| 5 |
Regioselective cycloaddition reaction of alkene molecules with the asymmetric dimer on Si(100)c(4x2)
Oguchi K, Nagao M, Umeyama H, Katayama T, Yamashita Y, Mukai K, Yoshinobu J, Akagi K, Tsuneyuki S
Journal of the American Chemical Society, 129(5), 1242, 2007 |
| 6 |
Structural and chemical property of unsaturated cyclic-hydrocarbon molecules regularly chemisorbed on Si(001) surface
Akagi K, Tsuneyuki S, Yamashita Y, Hamaguchi K, Yoshinobu J
Applied Surface Science, 234(1-4), 162, 2004 |
| 7 |
First-principles study on the strain effect of the Cu(001)-c(2 x 2)N self-organized structure
Yoshimoto Y, Tsuneyuki S
Applied Surface Science, 237(1-4), 274, 2004 |
| 8 |
Excited electronic state calculations by the transcorrelated variational Monte Carlo method: Application to a helium atom
Umezawa N, Tsuneyuki S
Journal of Chemical Physics, 121(15), 7070, 2004 |
| 9 |
Precursor mediated cycloaddition reaction of ethylene to the Si(100)c(4 x 2) surface
Nagao M, Umeyama H, Mukai K, Yamashita Y, Yoshinobu J, Akagi K, Tsuneyuki S
Journal of the American Chemical Society, 126(32), 9922, 2004 |
| 10 |
Transcorrelated method for electronic systems coupled with variational Monte Carlo calculation
Umezawa N, Tsuneyuki S
Journal of Chemical Physics, 119(19), 10015, 2003 |
