Simplified multiconfiguration self‐consistent field theory for localized orbitals. III. Evaluation of operators and matrix elements

The Journal of Chemical Physics ◽

10.1063/1.1682417 ◽

1974 ◽

Vol 61 (7) ◽

pp. 2814-2819 ◽

Author(s):

Herbert Schlosser

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Matrix Elements ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Multiconfiguration self-consistent field, theory of localized orbitals: Choice of localization potential

Chemical Physics Letters ◽

10.1016/0009-2614(73)89025-6 ◽

1973 ◽

Vol 23 (4) ◽

pp. 545-548 ◽

Author(s):

H. Schlosser

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Multiconfiguration self‐consistent‐field theory for localized orbitals. II. Overlap constraints, Lagrangian multipliers, and the screened interaction field

The Journal of Chemical Physics ◽

10.1063/1.1680827 ◽

1974 ◽

Vol 60 (10) ◽

pp. 3835-3844 ◽

Author(s):

T. L. Gilbert

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Lagrangian Multipliers ◽

Interaction Field ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Simplified Multiconfiguration Self‐Consistent‐Field Theory for Localized Orbitals. I Fixed Orbitals

The Journal of Chemical Physics ◽

10.1063/1.1678071 ◽

1972 ◽

Vol 57 (10) ◽

pp. 4332-4341 ◽

Author(s):

Herbert Schlosser

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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General quadratically convergent multiconfiguration self-consistent-field theory in terms of reduced matrix elements

Physical Review A ◽

10.1103/physreva.27.29 ◽

1983 ◽

Vol 27 (1) ◽

pp. 29-56 ◽

Author(s):

Clemens C. J. Roothaan ◽

John H. Detrich

Keyword(s):

Field Theory ◽

Matrix Elements ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Simplified Multiconfiguration Self‐Consistent‐Field Theory for Localized Orbitals. II Fluctuating Orbitals

The Journal of Chemical Physics ◽

10.1063/1.1678072 ◽

1972 ◽

Vol 57 (10) ◽

pp. 4342-4346 ◽

Author(s):

Herbert Schlosser

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Multiconfiguration Self-Consistent-Field Theory for Localized Orbitals. I. The Orbital Equations

Physical Review A ◽

10.1103/physreva.6.580 ◽

1972 ◽

Vol 6 (2) ◽

pp. 580-600 ◽

Author(s):

T. L. Gilbert

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Multiconfiguration self-consistent field theory of localized orbitals: The secular problem

Chemical Physics Letters ◽

10.1016/0009-2614(75)85322-x ◽

1975 ◽

Vol 35 (2) ◽

pp. 239-242 ◽

Author(s):

H. Schlosser

Keyword(s):

Field Theory ◽

Localized Orbitals ◽

Consistent Field ◽

Secular Problem ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Pseudopotential method for the direct construction of localized orbitals by multiconfiguration self-consistent field theory

Chemical Physics Letters ◽

10.1016/0009-2614(76)80729-4 ◽

1976 ◽

Vol 44 (3) ◽

pp. 563-568

Author(s):

Herbert Schlosser

Keyword(s):

Field Theory ◽

Pseudopotential Method ◽

Localized Orbitals ◽

Direct Construction ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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The Prediction of Microemulsion Properties: Molecular Theory and the Lattice Fluid Self-Consistent Field Theory

Tenside Surfactants Detergents ◽

10.3139/113.100359 ◽

2008 ◽

Vol 45 (1) ◽

pp. 21-24

Author(s):

S. Blagojević ◽

N. Potkonjak ◽

M. Ilić ◽

B. Kolarić

Keyword(s):

Field Theory ◽

Molecular Theory ◽

Lattice Fluid ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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Improved convergence in block copolymer self-consistent field theory by Anderson mixing

The Journal of Chemical Physics ◽

10.1063/1.1629673 ◽

2004 ◽

Vol 120 (1) ◽

pp. 31-34 ◽

Author(s):

R. B. Thompson ◽

K. O/. Rasmussen ◽

T. Lookman

Keyword(s):

Field Theory ◽

Block Copolymer ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Self Consistent Field Theory

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