MOLECULAR-ENERGIES IN PARTLY CHARGED ORGANIC-SOLIDS

被引：19

作者：

SOOS, ZG

机构：

[1] Department of Chemistry, Princeton University, Princeton

来源：

CHEMICAL PHYSICS LETTERS | 1979年 / 63卷 / 01期

关键词：

D O I：

10.1016/0009-2614(79)80485-6

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：

The energies ΔED(γ) and ΔEA(-γ) for a partly charged organic donor, Dγ+, and organic acceptor, Aγ-, are discussed in terms of a three-point fit based on γ=-1,0, and 1, as used in atomic electronegativities. Apparent difficulties with the existence and stability of partly charged (γ ≈ 1 2) 1:1 DA solids are resolved on using improved ΔED (γ) and ΔEA(-γ) values instead of the more common linear estimates. © 1979.

引用

页码：179 / 183

页数：5

共 25 条

[11] SITE REPRESENTATION FOR CHARGE TRANSFER EXCITATIONS IN MOLECULAR CRYSTALS [J].