PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
casr
2778 Calcium sulfide (Geo)
(Previous)
(Back)
(Next)
REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
OPEN(2,2) TRIPLET GEO-OK PM7
Calcium sulfide
<Ca-S> GR=JANAF86 GWT=0.5
Ca 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
S 2.31780000 +1 0.0000000 +0 0.0000000 +0 1 0 0