Chemical Reviews, Volume 91, Number 5
| Format | Journal |
| Language | English |
| Cover Date | July/August 1991 |
| Periodical Title | Chemical Reviews |
| Editor | Josef Michl |
| Associate Editor | John A. Gladysz |
| Guest Editor | Ernest R. Davidson |
| Publisher | American Chemical Society |
| Copyright Holder | American Chemical Society |
| Introduction by | Ernest R. Davidson |
| Format | Journal |
| Language | English |
| Location | Washington, DC |
| Cover Date | July/August 1991 |
| Pages / Font | 176 pages / 460 |
| ISSN | 0009-2665 |
| 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 Show all ▾ |
| Notes | Special issue on theoretical chemistry. |
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