ESC

Chemical Reviews, Volume 91, Number 5

FormatJournal
LanguageEnglish
Cover DateJuly/August 1991
Periodical TitleChemical Reviews
EditorJosef Michl
Associate EditorJohn A. Gladysz
Guest EditorErnest R. Davidson
PublisherAmerican Chemical Society
Copyright HolderAmerican Chemical Society
Introduction byErnest R. Davidson
FormatJournal
LanguageEnglish
LocationWashington, DC
Cover DateJuly/August 1991
Pages / Font176 pages / 460
ISSN0009-2665
Chapters
Quantum Theory of Matter: Introduction, by Ernest R. Davidson…649 Approximate density functional theory as a practical tool in molecular energetics and dynamics, by Tom Ziegler…651-667 Double-Rydberg molecular anions, by Jack Simons and Maciej Gutowski…669-677 Selected topics in ab initio computational chemistry in both very small and very large chemical systems, by Enrico Clementi, Giorgina Corongiu, Deleep Bahattacharya, Bradley Feuston, Daniel Frye, Alexandra Preiskorn, Antonio Rizzo, and Weige Xue…679-699 The study of molecular spectroscopy by ab initio methods, by Charles W. Bauschlicher and Stephen R. Langhoff…701-718 The electronic structure of actinide-containing molecules: a challenge to applied quantum chemistry, by Melanie Pepper and Bruce E. Bursten…719-741 Ab initio calculations of transition-metal organometallics: structure and molecular properties, by Alain Veillard…743-766 Quantum chemical probes of electron-transfer kinetics: the nature of donor-acceptor interactions, by Marshall D. Newton…767-792 Contribution of theoretical chemistry to the study of ion transport through membranes, by A. Pullman…793-812 Metal-ligand exchange coupling in transition-metal complexes, by Marshall G. Cory and Michael C. Zerner…813-822 Ab initio molecular orbital studies of catalytic elementary reactions and catalytic cycles of transition-metal complexes, by Nobuaki Koga and Keiji Morokuma…823-842 Quantum chemistry and molecular engineering of oligomeric and polymeric materials for optoelectronics, by Jean-Marie Andre and Joseph Delhalle…843-865 Theoretical analysis of spectra of short polyenes, by Giorgio Orlandi, Francesco Zerbetto, and Marek Z. Zgierski…867-891 A quantum theory of molecular structure and its applications, by Richard F. W. Bader…893-928 Applications of spin-coupled valence bond theory, by David L. Cooper, Joseph. Gerratt, and Mario. Raimondi…929-964 Conceptual aspects of structure-property correlations and electronic instabilities, with applications to low-dimensional transition-metal oxides, by Enric Canadell and Myung Hwan Whangbo…965-1034 Quantum chemistry of small clusters of elements of groups Ia, Ib, and IIa: fundamental concepts, predictions, and interpretation of experiments, by Vlasta Bonacic-Koutecky, Piercarlo Fantucci, and Jaroslav Koutecky…1035-1108
Quantum Theory of Matter: Introduction, by Ernest R. Davidson…649 Approximate density functional theory as a practical tool in molecular energetics and dynamics, by Tom Ziegler…651-667 Double-Rydberg molecular anions, by Jack Simons and Maciej Gutowski…669-677 Selected topics in ab initio computational chemistry in both very small and very large chemical systems, by Enrico Clementi, Giorgina Corongiu, Deleep Bahattacharya, Bradley Feuston, Daniel Frye, Alexandra Preiskorn, Antonio Rizzo, and Weige Xue…679-699 The study of molecular spectroscopy by ab initio methods, by Charles W. Bauschlicher and Stephen R. Langhoff…701-718 The electronic structure of actinide-containing molecules: a challenge to applied quantum chemistry, by Melanie Pepper and Bruce E. Bursten…719-741 Ab initio calculations of transition-metal organometallics: structure and molecular properties, by Alain Veillard…743-766 Quantum chemical probes of electron-transfer kinetics: the nature of donor-acceptor interactions, by Marshall D. Newton…767-792 Contribution of theoretical chemistry to the study of ion transport through membranes, by A. Pullman…793-812 Metal-ligand exchange coupling in transition-metal complexes, by Marshall G. Cory and Michael C. Zerner…813-822 Ab initio molecular orbital studies of catalytic elementary reactions and catalytic cycles of transition-metal complexes, by Nobuaki Koga and Keiji Morokuma…823-842 Quantum chemistry and molecular engineering of oligomeric and polymeric materials for optoelectronics, by Jean-Marie Andre and Joseph Delhalle…843-865 Theoretical analysis of spectra of short polyenes, by Giorgio Orlandi, Francesco Zerbetto, and Marek Z. Zgierski…867-891 A quantum theory of molecular structure and its applications, by Richard F. W. Bader…893-928 Applications of spin-coupled valence bond theory, by David L. Cooper, Joseph. Gerratt, and Mario. Raimondi…929-964 Conceptual aspects of structure-property correlations and electronic instabilities, with applications to low-dimensional transition-metal oxides, by Enric Canadell and Myung Hwan Whangbo…965-1034 Quantum chemistry of small clusters of elements of groups Ia, Ib, and IIa: fundamental concepts, predictions, and interpretation of experiments, by Vlasta Bonacic-Koutecky, Piercarlo Fantucci, and Jaroslav Koutecky…1035-1108
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NotesSpecial issue on theoretical chemistry.
Added by ThomasP64