Title of article :
The Na + HF reactive probabilities calculations using two different potential energy surfaces
Author/Authors :
Espinola Lَpez، نويسنده , , L.E. and Gargano، نويسنده , , Ricardo and Mundim، نويسنده , , Kleber C. and Soares Neto، نويسنده , , J.J.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2002
Pages :
6
From page :
271
To page :
276
Abstract :
The Na + HF reactive probabilities calculations considering two different potential energy surfaces: Bond order 5 (BO5) and generalized simulated annealing (GSA) are presented. From a comparison between the results of those calculations it was verified that the main features found for the GSA reactive probabilities (RP) agree with those found for the BO5 RP.
Journal title :
Chemical Physics Letters
Serial Year :
2002
Journal title :
Chemical Physics Letters
Record number :
1781706
Link To Document :
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