Molecular one-electron integrals over slater-type atomic orbitals and irregular solid spherical harmonics

International Journal of Quantum Chemistry ◽

10.1002/qua.560060304 ◽

1972 ◽

Vol 6 (3) ◽

pp. 413-438 ◽

Author(s):

E. Otto Steinborn ◽

Klaus Ruedenberg

Keyword(s):

Spherical Harmonics ◽

Slater Type ◽

Atomic Orbitals ◽

Solid Spherical Harmonics

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Evaluation of one-centre electron interaction integrals over slater type atomic orbitals

Pramana ◽

10.1007/bf02845776 ◽

1987 ◽

Vol 29 (4) ◽

pp. 385-390 ◽

Author(s):

Anil Kumar ◽

P C Mishra

Keyword(s):

Electron Interaction ◽

Slater Type ◽

Atomic Orbitals

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Analytical Evaluation of Three‐Center Nuclear‐Attraction Integrals with Slater‐Type Atomic Orbitals

The Journal of Chemical Physics ◽

10.1063/1.1676870 ◽

1972 ◽

Vol 56 (1) ◽

pp. 337-343 ◽

Author(s):

S. Bosanao ◽

M. Randio

Keyword(s):

Analytical Evaluation ◽

Slater Type ◽

Atomic Orbitals ◽

Nuclear Attraction

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Basis sets of gaussian and Slater-type atomic orbitals

Chemical Physics Letters ◽

10.1016/0009-2614(70)80161-0 ◽

1970 ◽

Vol 7 (5) ◽

pp. 511-516 ◽

Author(s):

D.M. Silver

Keyword(s):

Slater Type ◽

Atomic Orbitals

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Implementation of a Density Functional Theory-Based Method for the Calculation of the HyperfineA-tensor in Periodic Systems with the Use of Numerical and Slater Type Atomic Orbitals: Application to Paramagnetic Defects

The Journal of Physical Chemistry A ◽

10.1021/jp800494m ◽

2008 ◽

Vol 112 (19) ◽

pp. 4521-4526 ◽

Author(s):

Eugene S. Kadantsev ◽

Tom Ziegler

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Periodic Systems ◽

Slater Type ◽

Functional Theory ◽

Atomic Orbitals

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Rotation matrices for real spherical harmonics: general rotations of atomic orbitals in space-fixed axes

Journal of Physics A Mathematical and Theoretical ◽

10.1088/1751-8113/40/7/011 ◽

2007 ◽

Vol 40 (7) ◽

pp. 1597-1610 ◽

Author(s):

Didier Pinchon ◽

Philip E Hoggan

Keyword(s):

Spherical Harmonics ◽

Atomic Orbitals ◽

Rotation Matrices

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Implementation of a DFT-Based Method for the Calculation of the Zeemang-Tensor in Periodic Systems with the Use of Numerical and Slater-Type Atomic Orbitals

The Journal of Physical Chemistry A ◽

10.1021/jp805466c ◽

2009 ◽

Vol 113 (7) ◽

pp. 1327-1334 ◽

Author(s):

Eugene S. Kadantsev ◽

Tom Ziegler

Keyword(s):

Periodic Systems ◽

Slater Type ◽

Atomic Orbitals

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Erratum: Comment on the Translation of Slater‐Type Atomic Orbitals

The Journal of Chemical Physics ◽

10.1063/1.1678808 ◽

1972 ◽

Vol 57 (8) ◽

pp. 3586-3586

Author(s):

Walter England ◽

Klaus Ruedenberg

Keyword(s):

Slater Type ◽

Atomic Orbitals

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Relations between the norms of a function and its gradient in classes of surface and solid spherical harmonics on a finite-dimensional space

Vestnik St Petersburg University Mathematics ◽

10.3103/s1063454108020106 ◽

2008 ◽

Vol 41 (2) ◽

pp. 167-170

Author(s):

K. V. Kholshevnikov ◽

V. Sh. Shaidulin

Keyword(s):

Spherical Harmonics ◽

Dimensional Space ◽

Finite Dimensional Space ◽

Finite Dimensional ◽

Solid Spherical Harmonics

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Exact Gaussian expansions of Slater-type atomic orbitals

Journal of Computational Chemistry ◽

10.1002/jcc.10090 ◽

2002 ◽

Vol 23 (10) ◽

pp. 1007-1012 ◽

Author(s):

Andr� Severo Pereira Gomes ◽

Rog�rio Custodio

Keyword(s):

Slater Type ◽

Atomic Orbitals

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On the Expansion Formula of Atomic Orbitals in Spherical Harmonics around Another Center

Journal of the Physical Society of Japan ◽

10.1143/jpsj.11.980 ◽

1956 ◽

Vol 11 (9) ◽

pp. 980-986 ◽

Author(s):

Yukito Tanabe

Keyword(s):

Spherical Harmonics ◽

Expansion Formula ◽

Atomic Orbitals

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