Linear augmented Slater-type orbital method for free standing clusters

K. S. Kang; J. W. Davenport; J. Glimm; D. E. Keyes; M. McGuigan

doi:10.1002/jcc.21138

Linear augmented Slater-type orbital method for free standing clusters

Journal of Computational Chemistry ◽

10.1002/jcc.21138 ◽

2009 ◽

Vol 30 (8) ◽

pp. 1185-1193

Author(s):

K. S. Kang ◽

J. W. Davenport ◽

J. Glimm ◽

D. E. Keyes ◽

M. McGuigan

Keyword(s):

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Free Standing ◽

Type Orbital

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Spin-Polarized Relativistic Calculations in Linear Augmented-Slater-Type-Orbital Method

Electronic Structure ◽

10.1088/2516-1075/ac0f54 ◽

2021 ◽

Author(s):

Hiroshi Yamagami ◽

Yohei Kitawaki

Keyword(s):

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital ◽

Spin Polarized

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Linear augmented-Slater-type-orbital method for electronic-structure calculations. IV.5d-5dalloys

Physical Review B ◽

10.1103/physrevb.34.8421 ◽

1986 ◽

Vol 34 (12) ◽

pp. 8421-8429 ◽

Cited By ~ 23

Author(s):

R. E. Watson ◽

J. W. Davenport ◽

M. Weinert

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital ◽

Structure Calculations

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Linear augmented-Slater-type-orbital method for electronic-structure calculations

Physical Review B ◽

10.1103/physrevb.29.2896 ◽

1984 ◽

Vol 29 (6) ◽

pp. 2896-2904 ◽

Cited By ~ 75

Author(s):

J. W. Davenport

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital ◽

Structure Calculations

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Linear augmented-Slater-type-orbital method for electronic-structure calculations. III. Structural and cohesive energies of the 5delements Lu–Au

Physical Review B ◽

10.1103/physrevb.32.4883 ◽

1985 ◽

Vol 32 (8) ◽

pp. 4883-4891 ◽

Cited By ~ 41

Author(s):

J. W. Davenport ◽

R. E. Watson ◽

M. Weinert

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital ◽

Cohesive Energies ◽

Structure Calculations

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Linear augmented-Slater-type-orbital method for electronic-structure calculations. V. Spin-orbit splitting inCu3Au

Physical Review B ◽

10.1103/physrevb.37.9985 ◽

1988 ◽

Vol 37 (17) ◽

pp. 9985-9992 ◽

Cited By ~ 46

Author(s):

J. W. Davenport ◽

R. E. Watson ◽

M. Weinert

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Method ◽

Spin Orbit ◽

Slater Type ◽

Slater Type Orbital ◽

Orbit Splitting ◽

Type Orbital ◽

Spin Orbit Splitting ◽

Structure Calculations

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Full-potential linear augmented–Slater-type-orbital method

Physical Review B ◽

10.1103/physrevb.40.2757 ◽

1989 ◽

Vol 40 (5) ◽

pp. 2757-2766 ◽

Cited By ~ 60

Author(s):

G. W. Fernando ◽

J. W. Davenport ◽

R. E. Watson ◽

M. Weinert

Keyword(s):

Orbital Method ◽

Full Potential ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital

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Linear augmented-Slater-type-orbital method for electronic-structure calculations. II. bcc, fcc, and hcp W

Physical Review B ◽

10.1103/physrevb.32.4876 ◽

1985 ◽

Vol 32 (8) ◽

pp. 4876-4882 ◽

Cited By ~ 32

Author(s):

J. W. Davenport ◽

M. Weinert ◽

R. E. Watson

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital ◽

Structure Calculations

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Implementation of the Linear Augmented Slater-Type Orbital Method in the LDA + U Approximation

Physics of the Solid State ◽

10.1134/1.2131147 ◽

2005 ◽

Vol 47 (11) ◽

pp. 2072

Author(s):

N. G. Yakutovich

Keyword(s):

Orbital Method ◽

Slater Type ◽

Slater Type Orbital ◽

Type Orbital

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Positron Annihilation in Perfect and Defective TiO<sub>2</sub> Rutile Crystal with Single Particle Wave Function: Slater Type Orbital and Modified Jastrow Functions

World Journal of Nuclear Science and Technology ◽

10.4236/wjnst.2014.41006 ◽

2014 ◽

Vol 04 (01) ◽

pp. 33-39 ◽

Cited By ~ 4

Author(s):

Trinh Hoa Lang ◽

Chau Van Tao ◽

Kieu Tien Dung ◽

Le Hoang Chien

Keyword(s):

Wave Function ◽

Positron Annihilation ◽

Single Particle ◽

Slater Type ◽

Slater Type Orbital ◽

Single Particle Wave Function ◽

Type Orbital ◽

Rutile Crystal ◽

Particle Wave Function

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Application of Löwdin's canonical orthogonalization method to the Slater-type orbital configuration-interaction basis set

International Journal of Quantum Chemistry ◽

10.1002/qua.24867 ◽

2015 ◽

Vol 115 (7) ◽

pp. 434-441 ◽

Cited By ~ 7

Author(s):

Li Guang Jiao ◽

Yew Kam Ho

Keyword(s):

Configuration Interaction ◽

Basis Set ◽

Slater Type ◽

Slater Type Orbital ◽

Orthogonalization Method ◽

Type Orbital ◽

Orbital Configuration

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