Recursive evaluation of 3j and 6j coefficients
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Title of program: M2-RECURSION OF 3J-COEFFICIENTS
Catalogue Id: ACWR_v1_0
Nature of problem
Subroutine REC3JM generates 3j-coefficients from the exact solution of a recursion equation. The algorithm is more efficient and accurate than those based on explicit expressions, particularly in the commonly arising case in which a complete set of 3j-coefficients is needed. The algorithm is numerically stable for large quantum numbers which occur in problems of molecular dynamics.
Versions of this program held in the CPC repository in Mendeley Data
acwr_v1_0; M2-RECURSION OF 3J-COEFFICIENTS; 10.1016/0010-4655(76)90058-8
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
程序标题:3j 系数递归算法
目录编号:ACWR_v1_0
问题性质
子程序 REC3JM 通过递归方程的精确解生成 3j 系数。相较于基于显式表达式的算法,该算法在效率与精度方面均有所提升,尤其是在需要完整 3j 系数集的常见情形中。此外,该算法在分子动力学问题中常见的大量子数情况下,表现出良好的数值稳定性。
Mendeley 数据库中 CPC 仓库中保存的该程序版本
acwr_v1_0;M2-RECURSION OF 3J-COEFFICIENTS;10.1016/0010-4655(76)90058-8
本程序源自贝尔法斯特女王大学所保存的 CPC 程序库(1969-2019年)
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doi.org



