Reduced density matrices for valence-bond wave functions

International Journal of Quantum Chemistry ◽

10.1002/qua.560010654 ◽

2009 ◽

Vol 1 (S1) ◽

pp. 487-510 ◽

Cited By ~ 5

Author(s):

W. R. Thorson ◽

J. H. Choi ◽

R. B. Hake

Keyword(s):

Valence Bond ◽

Wave Functions ◽

Density Matrices ◽

Reduced Density Matrices ◽

Reduced Density

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Nonorthogonal orbital basedN-body reduced density matrices and their applications to valence bond theory. I. Hamiltonian matrix elements between internally contracted excited valence bond wave functions

The Journal of Chemical Physics ◽

10.1063/1.4801631 ◽

2013 ◽

Vol 138 (16) ◽

pp. 164119 ◽

Cited By ~ 23

Author(s):

Zhenhua Chen ◽

Xun Chen ◽

Wei Wu

Keyword(s):

Valence Bond ◽

Wave Functions ◽

Hamiltonian Matrix ◽

Matrix Elements ◽

Density Matrices ◽

Reduced Density Matrices ◽

Valence Bond Theory ◽

Bond Theory ◽

Reduced Density

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Nonorthogonal orbital based N-body reduced density matrices and their applications to valence bond theory. IV. The automatic implementation of the Hessian based VBSCF method

The Journal of Chemical Physics ◽

10.1063/1.4901729 ◽

2014 ◽

Vol 141 (19) ◽

pp. 194113 ◽

Cited By ~ 12

Author(s):

Xun Chen ◽

Zhenhua Chen ◽

Wei Wu

Keyword(s):

Valence Bond ◽

Density Matrices ◽

Reduced Density Matrices ◽

Valence Bond Theory ◽

Bond Theory ◽

Reduced Density

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Propagating two-particle reduced density matrices without wave functions

Physical Review A ◽

10.1103/physreva.91.023412 ◽

2015 ◽

Vol 91 (2) ◽

Cited By ~ 31

Author(s):

Fabian Lackner ◽

Iva Březinová ◽

Takeshi Sato ◽

Kenichi L. Ishikawa ◽

Joachim Burgdörfer

Keyword(s):

Wave Functions ◽

Density Matrices ◽

Reduced Density Matrices ◽

Reduced Density

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Reduced Density Matrices for Valence Bond Wavefunctions. III. Density Matrices for the 4×4 Square Planar Net

The Journal of Chemical Physics ◽

10.1063/1.1677955 ◽

1972 ◽

Vol 57 (1) ◽

pp. 252-270 ◽

Cited By ~ 11

Author(s):

Jong H. Choi ◽

Walter R. Thorson

Keyword(s):

Valence Bond ◽

Density Matrices ◽

Reduced Density Matrices ◽

Square Planar ◽

Reduced Density

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Reduced Density Matrices for Valence Bond Wavefunctions. II. Symmetry and Reduction Procedures for Square Planar Nets

The Journal of Chemical Physics ◽

10.1063/1.1677954 ◽

1972 ◽

Vol 57 (1) ◽

pp. 238-251 ◽

Cited By ~ 2

Author(s):

Jong H. Choi ◽

Richard P. Messmer ◽

Walter R. Thorson

Keyword(s):

Valence Bond ◽

Density Matrices ◽

Reduced Density Matrices ◽

Square Planar ◽

Reduced Density

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Quantum Chemistry without Wave Functions: Two-Electron Reduced Density Matrices

Accounts of Chemical Research ◽

10.1021/ar050029d ◽

2006 ◽

Vol 39 (3) ◽

pp. 207-215 ◽

Cited By ~ 88

Author(s):

David A. Mazziotti

Keyword(s):

Quantum Chemistry ◽

Wave Functions ◽

Density Matrices ◽

Reduced Density Matrices ◽

Reduced Density

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Nonorthogonal orbital based N-body reduced density matrices and their applications to valence bond theory. II. An efficient algorithm for matrix elements and analytical energy gradients in VBSCF method

The Journal of Chemical Physics ◽

10.1063/1.4801632 ◽

2013 ◽

Vol 138 (16) ◽

pp. 164120 ◽

Cited By ~ 35

Author(s):

Zhenhua Chen ◽

Xun Chen ◽

Wei Wu

Keyword(s):

Efficient Algorithm ◽

Valence Bond ◽

Matrix Elements ◽

Density Matrices ◽

Reduced Density Matrices ◽

Valence Bond Theory ◽

Bond Theory ◽

Reduced Density

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3,5-contracted Schr�dinger equation: Determining quantum energies and reduced density matrices without wave functions

International Journal of Quantum Chemistry ◽

10.1002/(sici)1097-461x(1998)70:4/5<557::aid-qua2>3.0.co;2-u ◽

1998 ◽

Vol 70 (4-5) ◽

pp. 557-570 ◽

Cited By ~ 82

Author(s):

David A. Mazziotti

Keyword(s):

Wave Functions ◽

Density Matrices ◽

Reduced Density Matrices ◽

Dinger Equation ◽

Reduced Density

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Renormalization of the reduced density matrices for inhomogeneous quantum fluids. II

Bulletin de la Classe des sciences ◽

10.3406/barb.1973.60688 ◽

1973 ◽

Vol 59 (1) ◽

pp. 230-253

Author(s):

Linda E. Reichl

Keyword(s):

Quantum Fluids ◽

Density Matrices ◽

Reduced Density Matrices ◽

Reduced Density ◽

Inhomogeneous Quantum

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Reduced Density Matrices

10.1007/978-3-642-58304-9 ◽

2000 ◽

Cited By ~ 325

Author(s):

A. John Coleman ◽

Vyacheslav I. Yukalov

Keyword(s):

Density Matrices ◽

Reduced Density Matrices ◽

Reduced Density

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