ELECTROSTATIC INTERACTION OF A SOLUTE WITH A CONTINUUM - A DIRECT UTILIZATION OF ABINITIO MOLECULAR POTENTIALS FOR THE PREVISION OF SOLVENT EFFECTS

被引:8658
作者
MIERTUS, S
SCROCCO, E
TOMASI, J
机构
[1] CNR, IST CHIM QUANTIST & ENERGET MOLEC, I-56100 PISA, ITALY
[2] SLOVAK ACAD SCI, INST POLYMER, CS-80934 BRATISLAVA, CZECHOSLOVAKIA
[3] UNIV PISA, IST CHIM PHYS, I-56100 PISA, ITALY
关键词
D O I
10.1016/0301-0104(81)85090-2
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:117 / 129
页数:13
相关论文
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