Erratum: Ab initio study of transition state spectroscopy: ClHCl− photodetachment spectrum [J. Chem. Phys. 93, 3716 (1990)]

Koichi Yamashita; Keiji Morokuma

doi:10.1063/1.460753

Erratum: Ab initio study of transition state spectroscopy: ClHCl− photodetachment spectrum [J. Chem. Phys. 93, 3716 (1990)]

The Journal of Chemical Physics ◽

10.1063/1.460753 ◽

1991 ◽

Vol 94 (1) ◽

pp. 831-831 ◽

Cited By ~ 3

Author(s):

Koichi Yamashita ◽

Keiji Morokuma

Keyword(s):

Transition State ◽

Ab Initio ◽

Chem Phys ◽

Ab Initio Study ◽

Photodetachment Spectrum

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Ab initio study of transition state spectroscopy: ClHCl− photodetachment spectrum

The Journal of Chemical Physics ◽

10.1063/1.458802 ◽

1990 ◽

Vol 93 (5) ◽

pp. 3716-3717 ◽

Cited By ~ 12

Author(s):

Koichi Yamashita ◽

Keiji Morokuma

Keyword(s):

Transition State ◽

Ab Initio ◽

Ab Initio Study ◽

Photodetachment Spectrum

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Erratum: The second hyperpolarizability of HCl and the effect of basis set variation on this property in hydrogen fluoride by fully coupled Hartree–Fock perturbation theory with a method for circumventing the transformation of two‐electron integrals. An ab initio study [J. Chem. Phys. 85, 2831 (1986)]

The Journal of Chemical Physics ◽

10.1063/1.455748 ◽

1988 ◽

Vol 89 (6) ◽

pp. 3931-3931

Author(s):

J. Waite ◽

M. G. Papadopoulos

Keyword(s):

Perturbation Theory ◽

Ab Initio ◽

Hydrogen Fluoride ◽

Chem Phys ◽

Basis Set ◽

Ab Initio Study ◽

Second Hyperpolarizability ◽

Hartree Fock ◽

Fully Coupled

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ChemInform Abstract: Ab initio Study on the Substituent Effect in the Transition State of Keto-Enol Tautomerism of Acetyl Derivatives.

ChemInform ◽

10.1002/chin.199620031 ◽

2010 ◽

Vol 27 (20) ◽

pp. no-no

Author(s):

C.-C. WU ◽

M.-H. LIEN

Keyword(s):

Transition State ◽

Ab Initio ◽

Substituent Effect ◽

Ab Initio Study

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Erratum: “Ab initio study of low-lying excited states of HCl: Accurate calculations of optical valence-shell excitations” [J. Chem. Phys. 137, 154304 (2012)]

The Journal of Chemical Physics ◽

10.1063/1.4788764 ◽

2013 ◽

Vol 138 (4) ◽

pp. 049901

Author(s):

Selma Engin ◽

Nicolas Sisourat ◽

Stéphane Carniato

Keyword(s):

Ab Initio ◽

Excited States ◽

Chem Phys ◽

Valence Shell ◽

Ab Initio Study

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Erratum: “Electronic spectra of the linear polyyne cations HC2nH+ (n=2–8): An ab initio study” [J. Chem. Phys. 131, 144307 (2009)]

The Journal of Chemical Physics ◽

10.1063/1.3260843 ◽

2009 ◽

Vol 131 (16) ◽

pp. 169904 ◽

Cited By ~ 1

Author(s):

Jinglai Zhang ◽

Xugeng Guo ◽

Zexing Cao

Keyword(s):

Ab Initio ◽

Electronic Spectra ◽

Chem Phys ◽

Ab Initio Study

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Ab initio study toward designing transition-state analogues which elicit proteolytic catalytic antibodies

Journal of Physical Organic Chemistry ◽

10.1002/(sici)1099-1395(200003)13:3<167::aid-poc215>3.0.co;2-m ◽

2000 ◽

Vol 13 (3) ◽

pp. 167-175 ◽

Cited By ~ 2

Author(s):

Kazuko Shimazaki ◽

Hiroyuki Kakinuma ◽

Kyoko Takahashi ◽

Shigeo Niihata ◽

Naoko Takahashi ◽

...

Keyword(s):

Transition State ◽

Ab Initio ◽

Catalytic Antibodies ◽

Ab Initio Study ◽

Transition State Analogues

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Erratum: “Ab initio study of the electronic spectrum of C2H2+: Investigation of structure and spectra involving low-lying doublet electronic states” [J. Chem. Phys. 109, 3086 (1998)]

The Journal of Chemical Physics ◽

10.1063/1.478994 ◽

1999 ◽

Vol 110 (17) ◽

pp. 8844-8844

Author(s):

M. Perić ◽

B. Ostojić ◽

B. Engels

Keyword(s):

Ab Initio ◽

Electronic Spectrum ◽

Electronic States ◽

Chem Phys ◽

Ab Initio Study

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ChemInform Abstract: On the Relationship Between Proximity and Reactivity. An ab initio Study of the Flexibility of the OH. + CH4 Hydrogen Abstraction Transition State and a Force-Field Model for the Transition States of Intramolecular Hydrogen Abstractio

ChemInform ◽

10.1002/chin.198840035 ◽

1988 ◽

Vol 19 (40) ◽

Author(s):

A. E. DORIGO ◽

K. N. HOUK

Keyword(s):

Transition State ◽

Force Field ◽

Ab Initio ◽

Field Model ◽

Hydrogen Abstraction ◽

Transition States ◽

Ab Initio Study ◽

Intramolecular Hydrogen ◽

The Relationship

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Inference of Transition State Geometries from Kinetic Isotope Effects: An Ab Initio Study of an E2 Model System

Journal of the American Chemical Society ◽

10.1021/ja00099a056 ◽

1994 ◽

Vol 116 (20) ◽

pp. 9302-9310 ◽

Cited By ~ 13

Author(s):

Sanne Schroeder Glad ◽

Frank Jensen

Keyword(s):

Transition State ◽

Ab Initio ◽

Isotope Effects ◽

Kinetic Isotope Effects ◽

Model System ◽

Ab Initio Study ◽

Kinetic Isotope

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Is There a Transition-State Imbalance for Proton Transfers in the Gas Phase? Ab Initio Study of the Carbon-to-Carbon Proton Transfer from Acetaldehyde to Its Enolate Ion

Journal of the American Chemical Society ◽

10.1021/ja00091a052 ◽

1994 ◽

Vol 116 (12) ◽

pp. 5405-5413 ◽

Cited By ~ 26

Author(s):

Claude F. Bernasconi ◽

Philip J. Wenzel

Keyword(s):

Proton Transfer ◽

Transition State ◽

Ab Initio ◽

Gas Phase ◽

Ab Initio Study ◽

Proton Transfers

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