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A general program to calculate angular momentum coefficients in relativistic atomic structure

✍ Scribed by I.P. Grant

Publisher: Elsevier Science
Year: 1984
Tongue: English
Weight: 69 KB
Volume: 35
Category: Article
ISSN: 0010-4655
DOI: 10.1016/s0010-4655(84)82426-1

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Programming language used: FORTRAN IV High speed storage required: 102 K bytes No. of bits in a byte: 8 Overlay structure: none No. of magnetic tapes required: none Other peripherals used: card reader, line printer No. of cards in combined program and test deck: 2465 CPC Libary subprograms used: Cat

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## Author of original program: p~G. Burke No. of cards required to effect adaptation (including directive cards): 4 Card punching code: BCD ## Nature ofphysical problem provement in time, but typically is of the order of 30%. The purpose of the program is to express the matrix Another factor w

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## Purpose of adaptation: to check the configuration input data for possible errors or inconsistencies.

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Let J be the total angular momentum quantum number of an N-electron system; let P be the system's parity quantum number; let (nh), or equivalently (nK), be an ordered set of relativistic subshells. The coitesponding complete active space (CAS) is the set of configuration symmetry functions, (I 7jP))