首页>
外文期刊>journal of chemical physics
>Madelung energy and theoretical zerohyphen;field splittings of (2:1) tetramethyltetraselenafulvalenium hexafluorophosphate lsqb;(TMTSF)2PF6rsqb;
【24h】
Madelung energy and theoretical zerohyphen;field splittings of (2:1) tetramethyltetraselenafulvalenium hexafluorophosphate lsqb;(TMTSF)2PF6rsqb;
展开▼
机译：Madelung energy and theoretical zerohyphen;field splittings of (2:1) tetramethyltetraselenafulvalenium hexafluorophosphate lsqb;(TMTSF)2PF6rsqb;
The Madelung energy of the organic superconductor (2:1) tetramethylselenafulvalenium hexafluorophosphate lsqb;(TMTSF)2PF6rsqb; is minus;236.5798 kJ/mol (minus;237.3152 kJ/mol if the PF6minus;ion rotates freely). Its theoretical finehyphen;structure splitting parameters are D = 0.014thinsp;288 cmminus;1and E = minus;0.000thinsp;557 cmminus;1lsqb;nearesthyphen;neighbor (TMTSF+)2dimerrsqb;.(AIP)
展开▼
