화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 Theoretical study on photoexcitation dynamics of a bis-diimine Cu(I) complex in solutions
Agena A, Iuchi S, Higashi M
Chemical Physics Letters, 679, 60, 2017
2 Improving DIIS convergence for metallic systems using Gaussian basis set
Sulzer D, Iuchi S, Yasuda K
Chemical Physics Letters, 635, 201, 2015
3 Theoretical study on ultrafast intersystem crossing of chromium(III) acetylacetonate
Ando H, Iuchi S, Sato H
Chemical Physics Letters, 535, 177, 2012
4 Spin-orbit coupling in a model Hamiltonian for d-d excited states of Ni2+ ion aqueous solution
Iuchi S, Sakaki S
Chemical Physics Letters, 485(1-3), 114, 2010
5 Hydrated Excess Proton at Water-Hydrophobic Interfaces
Iuchi S, Chen HN, Paesani F, Voth GA
Journal of Physical Chemistry B, 113(13), 4017, 2009
6 Potential energy surfaces and dynamics of Ni2+ ion aqueous solution: Molecular dynamics simulation of the electronic absorption spectrum
Iuchi S, Morita A, Kato S
Journal of Chemical Physics, 121(17), 8446, 2004
7 Molecular dynamics simulation with the charge response kernel: Vibrational spectra of liquid water and N-methylacetamide in aqueous solution
Iuchi S, Morita A, Kato S
Journal of Physical Chemistry B, 106(13), 3466, 2002