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有机金属化合物中二次,三次力常数的计算
引用本文:段春生 吴月顺. 有机金属化合物中二次,三次力常数的计算[J]. 青岛大学学报(自然科学版), 2000, 13(2): 34-37
作者姓名:段春生 吴月顺
作者单位:青岛大学师范学院化学系!青岛,266071
摘    要:利用精确势函数函数及离子-偶极子俘获力场势函数法,分别在已知有机金属化合物电子转移波长及离解能和有机配体极化率、偶极主其在重组态位矢的条件下,对该化合物二次、三次力进行了计算,并对两种计算方法进行了比较。

关 键 词:计算 力常数 有机金属化合物 二次力 三次力

THE CALCULATION OF THE QUADRATIC AND THE CUBIC FORCE CONSTANTS IN ORGANOMETALLIC COMPOUND
DUAN Chun-sheng, WU Yue-shun. THE CALCULATION OF THE QUADRATIC AND THE CUBIC FORCE CONSTANTS IN ORGANOMETALLIC COMPOUND[J]. Journal of Qingdao University(Natural Science Edition), 2000, 13(2): 34-37
Authors:DUAN Chun-sheng   WU Yue-shun
Affiliation:Qinsdao 266071
Abstract:On the condition of known electfon transfer wavelength dissociation energy,organic-ligand induction poltrizability dipole moment and position vector of reorganizationstate in organometallic compound, the quadratic and the cublc force constans were calculatedin the compounds by using accurate potental function method and ion-dipole capture forcefield potential function method. And the two methods were compared.
Keywords:Morse function   Capture force field potential function   Force constant Organometallic compound
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