five

BSR: B-spline atomic R-matrix codes

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Mendeley Data2023-02-23 更新2024-06-26 收录
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Abstract BSR is a general program to calculate atomic continuum processes using the B-spline R-matrix method, including electron–atom and electron–ion scattering, and radiative processes such as bound–bound transitions, photoionization and polarizabilities. The calculations can be performed in LS-coupling or in an intermediate-coupling scheme by including terms of the Breit–Pauli Hamiltonian. Title of program: BSR Catalogue Id: ADWY_v1_0 Nature of problem This program uses the R-matrix method to calculate electron-atom and electron-ion collision processes, with options to calculate radiative data, photoionization etc. The calculations can be performed in LS-coupling or in an intermediate-coupling scheme, with options to include Breit-Pauli terms in the Hamiltonian. Versions of this program held in the CPC repository in Mendeley Data ADWY_v1_0; BSR; 10.1016/j.cpc.2005.10.006 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

摘要 BSR是一款通用程序,可采用B样条R矩阵(B-spline R-matrix)方法计算原子连续谱过程,涵盖电子-原子、电子-离子散射,以及束缚态-束缚态跃迁、光电离、极化率等辐射过程。计算可采用LS耦合(LS-coupling)或中间耦合方案进行,且可纳入Breit-Pauli哈密顿量(Breit–Pauli Hamiltonian)的相关项。 程序名称:BSR 目录编号:ADWY_v1_0 程序功能说明 本程序采用R矩阵方法计算电子-原子与电子-离子碰撞过程,同时支持计算辐射数据、光电离等相关内容。计算可采用LS耦合或中间耦合方案,并可选择在哈密顿量中纳入Breit-Pauli修正项。 曼德莱数据(Mendeley Data)中CPC库内的本程序版本: ADWY_v1_0;BSR;10.1016/j.cpc.2005.10.006 本程序源自贝尔法斯特女王大学馆藏的CPC程序库(1969-2019年)。
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2020-01-06
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