COMPUTATIONAL MOLECULAR SPECTROSCOPY: THE EQUILIBRIUM BOND LENGTH OF $\tilde{X}\,^{3}\Phi$ CoH

Mutsumi Tomonari , Per Jensen , Kiyoshi Tanaka , Umpei Nagashima
Ohio State University

2007
2004
Electronic structure of CO adsorbed on small Cu clusters: Theoretical study on excited states.

Yuji Mochizuki , Kiyoshi Tanaka , Kimio Ohno , Hiroshi Tatewaki
Physical Review B 39 ( 16) 11907 -11913

8
1989
The second 3Σ−u state of O2

Megumu Yoshimine , Kiyoshi Tanaka , Hiroshi Tatewaki , Sigeru Obara
Journal of Chemical Physics 64 ( 5) 2254 -2255

64
1976
X‐ray scattering by water molecules studied by using synchrotron radiation

Hiroshi Takeuchi , Makoto Nakagawa , Takayuki Saito , Toru Egawa
International Journal of Quantum Chemistry 52 ( 6) 1339 -1348

9
1994
Theoretical study of the electronic structure of the lower states of the [Cr2Cl9]3- and [Mo2Cl9]3- ions.

Kiyoshi Tanaka , Masahiro Sekiya , Yoshihiro Tawada , Eisaku Miyoshi
Journal of Chemical Physics 122 ( 21) 214315 -214315

2005
A theoretical study on the potential surfaces of the lower electronic states of HCO

Kiyoshi Tanaka , Ernest R. Davidson
Journal of Chemical Physics 70 ( 6) 2904 -2913

93
1979
Theoretical study on electronic excitation spectra of Mo and Re cluster complexes: [(Mo6Cl8)Cl6]2− and [(Re6S8)Cl6]4−

Hiroaki Honda , Takeshi Noro , Kiyoshi Tanaka , Eisaku Miyoshi
Journal of Chemical Physics 114 ( 24) 10791 -10797

21
2001
Ab initio RHF, CI, and MC SCF calculations on the vanadyl ion

Helge Johansen , Kiyoshi Tanaka
Chemical Physics Letters 116 155 -159

2
1985
Electronic structure of the linear form of OCuO

Yuji Mochizuki , Kiyoshi Tanaka , Hiroshi Kashiwagi
Chemical Physics 151 ( 1) 11 -20

17
1991
Configuration interaction calculation of the O2 + ion and study of the photoelectron spectra of O2

Nobumitsu Honjou , Kiyoshi Tanaka , Kimio Ohno , Hiroshi Taketa
Molecular Physics 35 ( 6) 1569 -1578

33
1978
On the lower excited states of the formyl radical HCO

Kiyoshi Tanaka , Kouichi Takeshita
Chemical Physics Letters 87 ( 4) 373 -378

13
1982
An ab initio calculation of symmetric bending and stretching vibrational states of the H3O+ and D3O+ ions

Norihiro Shida , Kiyoshi Tanaka , Kimio Ohno
Chemical Physics Letters 104 ( 6) 575 -578

20
1984
A cluster expansion theory with multireference functions using the unitary ansatz

Kiyoshi Tanaka , Hidemi Terashima
Chemical Physics Letters 106 ( 6) 558 -562

56
1984
A theoretical study of ion dissociation of H2O2

Katsuyuki Nobusada , Kiyoshi Tanaka
Journal of Chemical Physics 112 ( 17) 7437 -7442

19
2000
Computer Chemistry Studies of Organic Reactions: The Wolff Rearrangement

Joachim Bargon , Kiyoshi Tanaka , Megumu Yoshimine
ChemInform 12 ( 20) 239 -274

2
1980
Theoretical study of the photoinduced transfer among the ground state and two metastable states in [Fe(CN)5NO]2−

Takeshi Ishikawa , Kiyoshi Tanaka
The Journal of Chemical Physics 122 ( 7) 074314

14
2005
An application of fragment interaction analysis based on local MP2

Takeshi Ishikawa , Yuji Mochizuki , Shinji Amari , Tatsuya Nakano
Chemical Physics Letters 463 ( 1) 189 -194

29
2008
Modification for spin-adapted version of configuration interaction singles with perturbative doubles

Yuji Mochizuki , Kiyoshi Tanaka
Chemical Physics Letters 443 ( 4) 389 -397

15
2007