Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules
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Published By Springer Netherlands

9789401075473, 9789400923294

Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Numerical MCSCF in One and Two Dimensions

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_25 ◽

1989 ◽

pp. 329-334 ◽

Cited By ~ 9

Author(s):

Dage Sundholm ◽

Jeppe Olsen ◽

Per-Åke Malmqvist ◽

Björn O. Roos

Keyword(s):

Two Dimensions

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Basic Mathematical Properties of Electronic Wave Functions in Momentum Space

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_2 ◽

1989 ◽

pp. 17-48

Author(s):

Edwin N. Lassettre

Keyword(s):

Momentum Space ◽

Wave Functions ◽

Electronic Wave ◽

Mathematical Properties ◽

Electronic Wave Functions

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Error Estimate in Variational Calculations of Eigenvalues and Eigenvectors

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_14 ◽

1989 ◽

pp. 257-261

Author(s):

G. Fonte ◽

G. Schiffrer ◽

D. Stanzial

Keyword(s):

Error Estimate ◽

Eigenvalues And Eigenvectors ◽

Variational Calculations

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Computational Strategies and New Applications in Green’s Function Monte Carlo

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_5 ◽

1989 ◽

pp. 107-129

Author(s):

B. H. Wells

Keyword(s):

Monte Carlo ◽

Green’S Function ◽

Green's Function ◽

New Applications ◽

Green's Function Monte Carlo

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Stochastic Methods in Quantum Mechanics

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_4 ◽

1989 ◽

pp. 85-105 ◽

Cited By ~ 1

Author(s):

Michel Caffarel

Keyword(s):

Quantum Mechanics ◽

Stochastic Methods

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On the Accuracy of the Algebraic Approximation in Relativistic Electronic Structure Calculations

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_24 ◽

1989 ◽

pp. 321-327

Author(s):

H. M. Quiney ◽

I. P. Grant ◽

S. Wilson

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Algebraic Approximation ◽

Structure Calculations

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Momentum Space Coordinate Transformations and their use in Numerical Orbital Calculations

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_18 ◽

1989 ◽

pp. 283-288

Author(s):

Y. Ishikawa ◽

S. A. Alexander

Keyword(s):

Momentum Space ◽

Coordinate Transformations ◽

Space Coordinate

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Prolate Spheroidal Wavefunctions

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_13 ◽

1989 ◽

pp. 251-256

Author(s):

M. Aubert-Frecon ◽

G. Hadinger

Keyword(s):

Prolate Spheroidal

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Quantum Chemistry by Random Walk: High Accuracy for Large Molecules

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_12 ◽

1989 ◽

pp. 245-250

Author(s):

James B. Anderson

Keyword(s):

Random Walk ◽

Quantum Chemistry ◽

High Accuracy ◽

Large Molecules

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Should Numerical Orbital Calculations be done with Basis Sets?

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules ◽

10.1007/978-94-009-2329-4_11 ◽

1989 ◽

pp. 239-244

Author(s):

S. A. Alexander ◽

H. J. Monkhorst

Keyword(s):

Basis Sets

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Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic MoleculesLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Springer Netherlands

Numerical MCSCF in One and Two Dimensions

Basic Mathematical Properties of Electronic Wave Functions in Momentum Space

Error Estimate in Variational Calculations of Eigenvalues and Eigenvectors

Computational Strategies and New Applications in Green’s Function Monte Carlo

Stochastic Methods in Quantum Mechanics

On the Accuracy of the Algebraic Approximation in Relativistic Electronic Structure Calculations

Momentum Space Coordinate Transformations and their use in Numerical Orbital Calculations

Prolate Spheroidal Wavefunctions

Quantum Chemistry by Random Walk: High Accuracy for Large Molecules

Should Numerical Orbital Calculations be done with Basis Sets?

Numerical Determination of the Electronic Structure of Atoms, Diatomic and Polyatomic Molecules
Latest Publications