Program for evaluation of non-exchange type integrals required in electron-atom scattering theory using slater-type orbitals as basis functions
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Title of program: NETI Catalogue Id: AAGP_v1_0 Nature of problem The problem of electron scattering from atoms and other quantum mechanical scattering problems can be solved using algebraic variational methods. ... CORRECTION SUMMARY: Vol:Year:Page 8:1974:333 "000ACORRECTION 19/07/74" "Program for evaluation of non-exchange type integrals required in electron-atom scattering theory using Slater-type orbitals as basis functions. (C.P.C. 5(1973)80)." R.L. Smith; D.G. Truhlar ADAPTATION SUMMARY: Vol:Year:Page 9:1975:327 "0001 NETI/ETI" "Continuum exchange integrals for algebraic variational calculations of electron-atom scattering using Slater-type orbitals as basis functions." J. Abdallah Jr.; D.G. Truhlar 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 AAGP_v1_0; NETI; 10.1016/0010-4655(73)90014-3 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
程序名称:NETI 目录编号:AAGP_v1_0 问题本质: 电子与原子及其他量子力学散射问题,均可通过代数变分方法进行求解…… 修正说明: 卷:年份:页码:8:1974:333 "000ACORRECTION 19/07/74" "本程序用于计算电子-原子散射理论中所需的非交换型积分,以斯莱特型轨道(Slater-type orbitals)作为基函数。(摘自《计算机物理学报》C.P.C. 5(1973)80)" 作者:R.L. Smith;D.G. Truhlar 适配说明: 卷:年份:页码:9:1975:327 "0001 NETI/ETI" "本程序针对以斯莱特型轨道为基函数的电子-原子散射代数变分计算,提供连续交换积分的相关计算功能。" 作者:J. Abdallah Jr.;D.G. Truhlar 注:适配相关说明详见源代码 注:修正相关说明详见源代码 本程序在Mendeley数据的CPC库中的版本信息: AAGP_v1_0; NETI; 10.1016/0010-4655(73)90014-3 本程序源自贝尔法斯特女王大学馆藏的CPC程序库(1969-2019)



