CHEMICAL-REACTIVITY IN SPIN-POLARIZED DENSITY FUNCTIONAL THEORY

被引:147
作者
GALVAN, M [1 ]
VELA, A [1 ]
GAZQUEZ, JL [1 ]
机构
[1] UNIV AUTONOMA METROPOLITANA IZTAPALAPA, DEPT QUIM, DIV CIENCIAS BASICAS & INGN, AP 55-534, MEXICO CITY 09340, DF, MEXICO
关键词
D O I
10.1021/j100333a056
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:6470 / 6474
页数:5
相关论文
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