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A general program to calculate the matrix of the spin-orbit interaction

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Mendeley Data2024-06-25 更新2024-06-26 收录
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Title of program: SPINORBITWEIGHTS Catalogue Id: AAKL_v1_0 Nature of problem In atomic structure calculations with configuration interaction, one has to evaluate the matrix of the hamiltonian with respect to a basis set of configuration wave functions. ... CORRECTION SUMMARY: Vol:Year:Page 10:1975:70 "000A CORRECTION 18/07/75" "A general program to calculate the matrix of the spin-orbit interaction. (C.P.C. 9(1975)102)." W.-D. Klotz ADAPTATION SUMMARY: Vol:Year:Page 10:1975:56 "0001 WKAPPAKQ" "Reduced matrix elements of summations of one-particle tensor products." W.-D. Klotz Note: adaptation instructions are contained in source code Note: correction instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data AAKL_v1_0; SPINORBITWEIGHTS; 10.1016/0010-4655(75)90027-2 AAKL_v2_0; SPINORBIT WEIGHTS 2; 10.1016/0010-4655(77)90013-3 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
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2024-01-23
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