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Theoretical study of the anions of BeF2 and MgF2

✍ Scribed by B.A.B. Seiders; W.L. Luken; R.P. Blickensderfer; K.D. Jordan


Publisher
Elsevier Science
Year
1979
Tongue
English
Weight
635 KB
Volume
39
Category
Article
ISSN
0301-0104

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Theoretical study of ScCO2+
✍ Mariona Sodupe; VicenΓ§ Branchadell; Antonio Oliva; Juan Bertran πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 165 KB πŸ‘ 2 views

The structure, binding energy, and vibrational frequencies have been determined for ScCO q . The inserted OSc q CO structure in the 1 AЈ state is the most stable 2 isomer and lies 43.2 kcalrmol below the ground-state Sc q q CO asymptote. The linear 2 1 -O Sc q -OCO 3 ⌬ state is bound by a charge᎐qua