An LCAO MO Self‐Consistent Field Calculation of the Ground State of H2O

Frank O. Ellison; Harrison Shull

doi:10.1063/1.1699259

An LCAO MO Self‐Consistent Field Calculation of the Ground State of H2O

The Journal of Chemical Physics ◽

10.1063/1.1699259 ◽

1953 ◽

Vol 21 (8) ◽

pp. 1420-1421 ◽

Cited By ~ 32

Author(s):

Frank O. Ellison ◽

Harrison Shull

Keyword(s):

Ground State ◽

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Lcao Mo

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Erratum: LCAO Self‐Consistent Field Calculation of the Ground State of CO2

The Journal of Chemical Physics ◽

10.1063/1.1699021 ◽

1953 ◽

Vol 21 (4) ◽

pp. 761-761

Author(s):

Joseph F. Mulligan

Keyword(s):

Ground State ◽

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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LCAO Self‐Consistent Field Calculation of the Ground State of Carbon Dioxide

The Journal of Chemical Physics ◽

10.1063/1.1748208 ◽

1951 ◽

Vol 19 (3) ◽

pp. 347-362 ◽

Cited By ~ 104

Author(s):

Joseph F. Mulligan

Keyword(s):

Carbon Dioxide ◽

Ground State ◽

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Characterization of Ground‐State Wavefunctions by Measured Electronic Properties. III. A Gaussian Basis Self‐Consistent‐Field Calculation for Nitrogen Trifluoride

The Journal of Chemical Physics ◽

10.1063/1.1671543 ◽

1969 ◽

Vol 50 (8) ◽

pp. 3214-3219 ◽

Cited By ~ 16

Author(s):

Mark L. Unland ◽

John H. Letcher ◽

John R. Van Wazer

Keyword(s):

Electronic Properties ◽

Ground State ◽

Field Calculation ◽

Nitrogen Trifluoride ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

State Wavefunctions

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Self‐Consistent Field Calculation of the Ground State of Methane

The Journal of Chemical Physics ◽

10.1063/1.1724917 ◽

1964 ◽

Vol 40 (10) ◽

pp. 2860-2864 ◽

Cited By ~ 24

Author(s):

Benjamin J. Woznick

Keyword(s):

Ground State ◽

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Molecular Calculations. I. LCAO MO Self‐Consistent Field Treatment of the Ground State of H2O

The Journal of Chemical Physics ◽

10.1063/1.1741879 ◽

1955 ◽

Vol 23 (12) ◽

pp. 2348-2357 ◽

Cited By ~ 151

Author(s):

Frank O. Ellison ◽

Harrison Shull

Keyword(s):

Ground State ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Molecular Calculations ◽

Lcao Mo

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Self-Consistent Field Calculation of the Nuclear Boundary Diffuseness

Physical Review ◽

10.1103/physrev.102.455 ◽

1956 ◽

Vol 102 (2) ◽

pp. 455-457 ◽

Cited By ~ 4

Author(s):

James D. Talman

Keyword(s):

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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A numerical Hartree self-consistent field calculation of an autoionization resonance parameters for a doubly excited 2s 2 , 3s 2 , and 4s 2 states of He atom with a complex absorbing potential

Chinese Physics B ◽

10.1088/1674-1056/26/8/083101 ◽

2017 ◽

Vol 26 (8) ◽

pp. 083101

Author(s):

Tsogbayar Tsednee ◽

Danny L Yeager

Keyword(s):

Field Calculation ◽

Resonance Parameters ◽

Consistent Field ◽

Doubly Excited ◽

Self Consistent ◽

Self Consistent Field ◽

He Atom

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Variational calculation with general density functional to solve the electronic Schrödinger equation directly for ground state: a recipe for self-consistent field solution

Journal of Theoretical and Applied Physics ◽

10.1186/2251-7235-7-61 ◽

2013 ◽

Vol 7 (1) ◽

pp. 61 ◽

Cited By ~ 1

Author(s):

Sandor Kristyan

Keyword(s):

Schrödinger Equation ◽

Ground State ◽

Schrodinger Equation ◽

Density Functional ◽

Variational Calculation ◽

Field Solution ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Numerical relativistic self-consistent field calculation of electron density and 〈r−3〉 for a number of electron configurations of iron and tin. Application to tin Mössbauer spectroscopy

The Journal of Chemical Physics ◽

10.1063/1.431324 ◽

1975 ◽

Vol 63 (12) ◽

pp. 5256-5262 ◽

Cited By ~ 26

Author(s):

J. L. K. F. de Vries ◽

J. M. Trooster ◽

P. Ros

Keyword(s):

Mössbauer Spectroscopy ◽

Electron Density ◽

Mossbauer Spectroscopy ◽

Field Calculation ◽

Mößbauer Spectroscopy ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Multi-configuration self-consistent-field calculation of the dissociation energy and electronic structure of hydrogen fluoride

Molecular Physics ◽

10.1080/00268977400100841 ◽

1974 ◽

Vol 27 (4) ◽

pp. 917-921 ◽

Cited By ~ 11

Author(s):

M. Krauss ◽

D. Neumann

Keyword(s):

Electronic Structure ◽

Hydrogen Fluoride ◽

Dissociation Energy ◽

Field Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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