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

Jinglai Zhang; Xugeng Guo; Zexing Cao

doi:10.1063/1.3260843

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

Download Full-text

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

Download Full-text

Ab Initio Study of the Effect of Solvation on the Electronic Spectra of Formamide andN-Methylacetamide

The Journal of Physical Chemistry A ◽

10.1021/jp982645f ◽

1998 ◽

Vol 102 (52) ◽

pp. 10791-10797 ◽

Cited By ~ 41

Author(s):

Nicholas A. Besley ◽

Jonathan D. Hirst

Keyword(s):

Ab Initio ◽

Electronic Spectra ◽

Ab Initio Study

Download Full-text

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

Download Full-text

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

Download Full-text

Erratum: “A search for manifestation of two types of collective excitations in dynamic structure of a liquid metal: Ab initio study of collective excitations in liquid Na” [J. Chem. Phys. 144, 194501 (2016)]

The Journal of Chemical Physics ◽

10.1063/1.4953241 ◽

2016 ◽

Vol 144 (21) ◽

pp. 219903

Author(s):

Taras Bryk ◽

J.-F. Wax

Keyword(s):

Liquid Metal ◽

Ab Initio ◽

Dynamic Structure ◽

Chem Phys ◽

Collective Excitations ◽

Ab Initio Study

Download Full-text

Publisher’s Note: “Matrix-isolation and ab initio study of HKrCCCl and HXeCCCl” [J. Chem. Phys. 143, 244319 (2015)]

The Journal of Chemical Physics ◽

10.1063/1.4940764 ◽

2016 ◽

Vol 144 (3) ◽

pp. 039902

Author(s):

Cheng Zhu ◽

Markku Räsänen ◽

Leonid Khriachtchev

Keyword(s):

Ab Initio ◽

Matrix Isolation ◽

Chem Phys ◽

Ab Initio Study

Download Full-text

Comment on “Ab initio study of MoS2and Li adsorbed on the (101̄0) face of MoS2” by V. Alexiev, R. Prins and Th. Weber, Phys. Chem. Chem. Phys., 2000, 2, 1815, and “DFT study of MoS2and hydrogen adsorbed on the (101̄0) face of MoS2” by V. Alexiev, R. Prins and Th. Weber, Phys. Chem. Chem. Phys., 2001, 3, 5326

Physical Chemistry Chemical Physics ◽

10.1039/b201528p ◽

2002 ◽

Vol 4 (16) ◽

pp. 4078-4079 ◽

Cited By ~ 3

Author(s):

Ricardo Grau-Crespo ◽

Rafael López-Cordero

Keyword(s):

Ab Initio ◽

Chem Phys ◽

Dft Study ◽

Ab Initio Study ◽

Phys Chem Chem Phys

Download Full-text

Electronic spectra of adenine and 2-aminopurine: an ab initio study of energy level diagrams of different tautomers in gas phase and aqueous solution

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/s1386-1425(99)00262-0 ◽

2000 ◽

Vol 56 (7) ◽

pp. 1355-1384 ◽

Cited By ~ 57

Author(s):

S.K Mishra ◽

M.K Shukla ◽

P.C Mishra

Keyword(s):

Aqueous Solution ◽

Energy Level ◽

Ab Initio ◽

Gas Phase ◽

Electronic Spectra ◽

Ab Initio Study

Download Full-text

An ab initio study of electronic spectra and excited-state properties of 7-azaindole in vapour phase and aqueous solution

Chemical Physics ◽

10.1016/s0301-0104(97)00351-0 ◽

1998 ◽

Vol 230 (2-3) ◽

pp. 187-200 ◽

Cited By ~ 26

Author(s):

M.K Shukla ◽

P.C Mishra

Keyword(s):

Aqueous Solution ◽

Excited State ◽

Ab Initio ◽

Electronic Spectra ◽

Vapour Phase ◽

Ab Initio Study

Download Full-text

Erratum: Ab initio study of geometrically metastable multiprotonated species: MHk+n [J. Chem. Phys. 97, 4272 (1992)]

The Journal of Chemical Physics ◽

10.1063/1.466245 ◽

1993 ◽

Vol 99 (1) ◽

pp. 769-770

Author(s):

Alexander I. Boldyrev ◽

Jack Simons

Keyword(s):

Ab Initio ◽

Chem Phys ◽

Ab Initio Study

Download Full-text