Ab initio MO studies on the potential energy surface of the methyl chloride radical anion

1992 ◽  
Vol 114 (5) ◽  
pp. 1593-1595 ◽  
Author(s):  
Tsukasa Tada ◽  
Reiko Yoshimura
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Radical Anion ◽  
Energy Surface ◽  
Methyl Chloride ◽  
Ab Initio Mo

Ab initio MO studies of van der Waals molecule (N2)2: Potential energy surface and internal motion

1998 ◽  
Vol 109 (21) ◽  
pp. 9434-9438 ◽  
Author(s):  
Akira Wada ◽  
Hideto Kanamori ◽  
Suehiro Iwata
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Van Der Waals ◽  
Internal Motion ◽  
Ab Initio Mo

A GAUSSIAN-1 Type Ab Initio MO Study of the [CH2NO]+Potential Energy Surface. Theoretical Support for the Existence of Three Experimentally Distinguishable Isomers in the Gas Phase

1993 ◽  
Vol 33 (3) ◽  
pp. 277-286 ◽  
Author(s):  
Jan Hrušák ◽  
Max C. Holthausen ◽  
Norman Goldberg ◽  
Muhammad Iraqi ◽  
Wolfram Koch ◽  
...  
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Gas Phase ◽  
Energy Surface ◽  
Theoretical Support ◽  
Ab Initio Mo ◽  
Type Ab

ChemInform Abstract: Ab initio MO Study of the CH3N2+ Potential Energy Surface.

ChemInform ◽  
1987 ◽  
Vol 18 (2) ◽  
Author(s):  
W. KOCH ◽  
N. HEINRICH ◽  
H. SCHWARZ
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Ab Initio Mo

scholarly journals POTENTIAL ENERGY SURFACE OF [Cu(H2O)6]2+AND [Zn(H2O)6]2+DERIVED FROM AB INITIO MO CALCULATIONS

1980 ◽  
Vol 9 (12) ◽  
pp. 1495-1496 ◽  
Author(s):  
Mitsuru Sano ◽  
Hideo Yamatera
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Mo Calculations ◽  
Ab Initio Mo Calculations ◽  
Ab Initio Mo

Ab initio MO study of potential energy surface of NH2 with CN reaction

2006 ◽  
Vol 106 (8) ◽  
pp. 1827-1843 ◽  
Author(s):  
Benni Du ◽  
Weichao Zhang
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Ab Initio Mo

Ab initio MO study of the potential energy surface of the HF⋯.Cl2 binary complex

1992 ◽  
Vol 259 ◽  
pp. 211-227 ◽  
Author(s):  
David.A. Barker ◽  
Alan Hinchliffe ◽  
Wagner B. De Almeida
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Binary Complex ◽  
Ab Initio Mo
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