Suehiro Iwata - Publications, H-index & Citations

Ab initio study of the isomers: HNNSi, HSiNN, and HNSiN

IF3.1

2006-07-07

OAAI

Rodriguez-Garcia, Valerie; Yagi, Kiyoshi; Hirao, Kimihiko; Iwata, Suehiro; Hirata, So

Theoretical prediction of intracluster reactions of B+(H2O)2 and B+(H2O)3:: Hybrid procedure of ab initio MO calculations and Monte Carlo samplings

IF3.8

2006-06-15

PREAI

Ornellas, FR; Iwata, S

Comparative ab initio and hybrid DFT studies relevant to an experimental investigation of neutral and cationic [Si, P, H-2] isomers

IF3.8

2006-06-15

PREAI

Watanabe, H; Asada, T; Iwata, S

Theoretical study of cyclic isomers of HNOx (x=2-6)

IF3.8

2006-06-13

PREAI

Hrusak, J; Schroder, D; Schwarz, H; Iwata, S

Perturbation expansion theory corrected from basis set superposition error. I. Locally projected excited orbitals and single excitations

IF3.8

2006-06-11

PREAI

Li, YM; Iwata, S

Theoretical studies on the molecular dependence of bond dissociation after core excitations II: CH3CO(CH2)nCN, n=0-3

IF3.1

2004-02-22

PREAI

Nagata, T; Iwata, S

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2003-06-17

PREAI

Takahashi, O; Joyabu, M; Mitani, M; Saito, K; Iwata, S

MOLECULAR-ORBITAL STUDY ON THE MECHANISM OF OXIDATION OF A BERYLLIUM ATOM IN ACIDIC SOLUTION

ANALYSIS OF THE OXIDATION-STATE AND OXIDATION NUMBER BY ABINITIO MOLECULAR-ORBITAL CALCULATIONS - CHLORINE AND SULFUR-COMPOUNDS

IF15.6

2002-05-01

PREAI

HASHIMOTO, K; YODA, N; OSAMURA, Y; IWATA, S

QUANTUM CHEMICAL INTERPRETATION OF OXIDATION NUMBER AS APPLIED TO CARBON AND OXYGEN COMPOUNDS - NUMERICAL-ANALYSIS OF THE ELECTRON-DISTRIBUTION WITH ABINITIO MOLECULAR-ORBITAL WAVE-FUNCTIONS

IF15.6

2002-05-01

PREAI

TAKANO, K; HOSOYA, H; IWATA, S

MOLECULAR-ORBITAL STUDIES OF THE STRUCTURES AND REACTIONS OF SINGLY CHARGED MAGNESIUM-ION WITH WATER CLUSTERS, MG+(H2O)(N)

IF15.6

2002-05-01

PREAI

TAKANO, K; HOSOYA, H; IWATA, S

Spectral density calculation by using the Chebyshev expansion

IF15.6

2002-05-01

138

PREAI

WATANABE, H; IWATA, S; HASHIMOTO, K; MISAIZU, F; FUKE, K

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2001-11-30

PREAI

Ikegami, T; Iwata, S

Basis set superposition error free self-consistent field method for molecular interaction in multi-component systems: Projection operator formalism

A theoretical study of Si4H2 cluster with ab initio and density functional theory methods

IF3.1

2001-08-22

OAAI

Nagata, T; Takahashi, O; Saito, K; Iwata, S

Theoretical study of multidimensional proton tunneling in the excited state of tropolone

IF3.1

2001-01-15

PREAI

Wang, WN; Tang, HR; Fan, KN; Iwata, S

Electronic isomers in [(CO2)nROH]- cluster anions.: II.: Ab initio calculations

IF3.1

2000-04-08

PREAI

Wójcik, MJ; Nakamura, H; Iwata, S; Tatara, W

Size-extensive calculations of static structure factors from the coupled cluster singles and doubles model

IF3.1

1999-10-08

PREAI

Saeki, M; Tsukuda, T; Iwata, S; Nagata, T

Photodissociation dynamics of argon cluster ions

IF3.1

1999-07-15

PREAI

Watanabe, N; Ten-no, S; Pal, S; Iwata, S; Udagawa, Y