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Theoretical thermochemistry of some LiXH/sub n/ and BeXH/sub n / compounds

Bibliographic reference Sana, M. ; Leroy, Georges. Theoretical thermochemistry of some LiXH/sub n/ and BeXH/sub n / compounds. In: Theoretica Chimica Acta, Vol. 77, no. 6, p. 383-394 (1990)
Permanent URL http://hdl.handle.net/2078.1/66324
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  44. BeBH(3?) is found to have a total energy of ?39.69957 hartrees at the MP4/6-31 + G(2df, p)// MP2/6-31G(d, p) level for itsC ?? equilibrium MP2 geometry withd(BeB)=1.639 Å andd(BH)=1.191 Å
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