Modern Electronic Structure Theory - Advanced Series in Physical Chemistry
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Published By World Scientific Publishing Company

9789810219604, 9789812832115

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COUPLED-CLUSTER THEORY: AN OVERVIEW OF RECENT DEVELOPMENTS

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0005 ◽

1995 ◽

pp. 1047-1131 ◽

Cited By ~ 242

Author(s):

Rodney J. Bartlett

Keyword(s):

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Recent Developments

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STUDIES OF ELECTRON–MOLECULE COLLISIONS ON MASSIVELY PARALLEL COMPUTERS

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0011 ◽

1995 ◽

pp. 1375-1462 ◽

Cited By ~ 11

Author(s):

Carl Winstead ◽

Vincent McKoy

Keyword(s):

Parallel Computers ◽

Massively Parallel ◽

Massively Parallel Computers

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EVALUATION OF BOND ENERGIES TO CHEMICAL ACCURACY BY QUANTUM CHEMICAL TECHNIQUES

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0003 ◽

1995 ◽

pp. 991-1021 ◽

Cited By ~ 17

Author(s):

Krishnan Raghavachari ◽

Larry A. Curtiss

Keyword(s):

Quantum Chemical ◽

Bond Energies ◽

Chemical Techniques

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FRONT MATTER

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_fmatter ◽

1995 ◽

pp. i-xiii

Author(s):

David R Yarkony

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THE APPLICATION OF AB INITIO ELECTRONIC STRUCTURE CALCULATIONS TO MOLECULES CONTAINING TRANSITION METAL ATOMS

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0010 ◽

1995 ◽

pp. 1280-1374 ◽

Cited By ~ 11

Author(s):

Charles W. Bauschlicher ◽

Stephen R. Langhoff ◽

Harry Partridge

Keyword(s):

Electronic Structure ◽

Transition Metal ◽

Ab Initio ◽

Electronic Structure Calculations ◽

Metal Atoms ◽

Transition Metal Atoms ◽

Structure Calculations ◽

Ab Initio Electronic Structure

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PSEUDOSPECTRAL METHODS APPLIED TO THE ELECTRON CORRELATION PROBLEM

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0006 ◽

1995 ◽

pp. 1132-1165 ◽

Cited By ~ 29

Author(s):

Todd J. Martinez ◽

Emily A. Carter

Keyword(s):

Electron Correlation ◽

Pseudospectral Methods ◽

Correlation Problem

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APPLICATIONS OF MOLECULAR STRUCTURE METHODS TO PROBLEMS IN ASTROCHEMISTRY

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0009 ◽

1995 ◽

pp. 1241-1279

Author(s):

Kate P. Kirby

Keyword(s):

Molecular Structure

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QUASIDEGENERATE PERTURBATION THEORY USING EFFECTIVE HAMILTONIANS

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0007 ◽

1995 ◽

pp. 1166-1190 ◽

Cited By ~ 8

Author(s):

Mark R. Hoffmann

Keyword(s):

Perturbation Theory ◽

Effective Hamiltonians

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GAUSSIAN BASIS SETS AND MOLECULAR INTEGRALS

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0001 ◽

1995 ◽

pp. 725-856 ◽

Cited By ~ 39

Author(s):

Trygve Helgaker ◽

Peter R. Taylor

Keyword(s):

Basis Sets ◽

Gaussian Basis Sets ◽

Molecular Integrals

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ANALYTICAL DERIVATIVE TECHNIQUES AND THE CALCULATION OF VIBRATIONAL SPECTRA

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry ◽

10.1142/9789812832115_0008 ◽

1995 ◽

pp. 1191-1240 ◽

Cited By ~ 44

Author(s):

Peter Pulay

Keyword(s):

Vibrational Spectra ◽

Calculation Of Vibrational Spectra

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Modern Electronic Structure Theory - Advanced Series in Physical ChemistryLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By World Scientific Publishing Company

COUPLED-CLUSTER THEORY: AN OVERVIEW OF RECENT DEVELOPMENTS

STUDIES OF ELECTRON–MOLECULE COLLISIONS ON MASSIVELY PARALLEL COMPUTERS

EVALUATION OF BOND ENERGIES TO CHEMICAL ACCURACY BY QUANTUM CHEMICAL TECHNIQUES

FRONT MATTER

THE APPLICATION OF AB INITIO ELECTRONIC STRUCTURE CALCULATIONS TO MOLECULES CONTAINING TRANSITION METAL ATOMS

PSEUDOSPECTRAL METHODS APPLIED TO THE ELECTRON CORRELATION PROBLEM

APPLICATIONS OF MOLECULAR STRUCTURE METHODS TO PROBLEMS IN ASTROCHEMISTRY

QUASIDEGENERATE PERTURBATION THEORY USING EFFECTIVE HAMILTONIANS

GAUSSIAN BASIS SETS AND MOLECULAR INTEGRALS

ANALYTICAL DERIVATIVE TECHNIQUES AND THE CALCULATION OF VIBRATIONAL SPECTRA

Modern Electronic Structure Theory - Advanced Series in Physical Chemistry
Latest Publications