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REACTIVE SCATTERING CALCULATIONS OF COLLINEAR TRIATOMIC SYSTEMS IN HYPERSPHERICAL COORDINATES BY FIRST-ORDER MAGNUS NUMERICAL PROPAGATION METHOD
Sun Qiyan; Wu Dayong; Lou Nanquan
刊名ACTA PHYSICO-CHIMICA SINICA
1988
DOI10.3866/PKU.WHXB19880314
4期:3页:296-300
收录类别SCI
文章类型Article
WOS标题词Science & Technology ; Physical Sciences
类目[WOS]Chemistry, Physical
研究领域[WOS]Chemistry
英文摘要Hyperepherical coordinates are employed in describing collinear triatomic reactive scattering. Close coupling differential equations are obtained by radial piece wise semi adiabatic expansion, and solved by first-order Magnus numerical propagation method with multistep exchange set and reorthogonalization procedures. Applicating to H + H-2 and F + H-2 systems, we obtained good results which are in accordance with results of other method for the same systems.
语种英语
WOS记录号WOS:000207571400014
引用统计
文献类型期刊论文
条目标识符http://cas-ir.dicp.ac.cn/handle/321008/139437
专题中国科学院大连化学物理研究所
作者单位Acad Sinica, Dalian Inst Chem Phys, Dalian, Peoples R China
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GB/T 7714
Sun Qiyan,Wu Dayong,Lou Nanquan. REACTIVE SCATTERING CALCULATIONS OF COLLINEAR TRIATOMIC SYSTEMS IN HYPERSPHERICAL COORDINATES BY FIRST-ORDER MAGNUS NUMERICAL PROPAGATION METHOD[J]. ACTA PHYSICO-CHIMICA SINICA,1988,4(3):296-300.
APA Sun Qiyan,Wu Dayong,&Lou Nanquan.(1988).REACTIVE SCATTERING CALCULATIONS OF COLLINEAR TRIATOMIC SYSTEMS IN HYPERSPHERICAL COORDINATES BY FIRST-ORDER MAGNUS NUMERICAL PROPAGATION METHOD.ACTA PHYSICO-CHIMICA SINICA,4(3),296-300.
MLA Sun Qiyan,et al."REACTIVE SCATTERING CALCULATIONS OF COLLINEAR TRIATOMIC SYSTEMS IN HYPERSPHERICAL COORDINATES BY FIRST-ORDER MAGNUS NUMERICAL PROPAGATION METHOD".ACTA PHYSICO-CHIMICA SINICA 4.3(1988):296-300.
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