Title of article :
Comment on `A computational study of the novel metastable compound HKrSHʹ [S.A.C. McDowell, Chem. Phys. Lett. 372 (2003) 553–556]
Author/Authors :
Lundell، نويسنده , , J. and Khriachtchev، نويسنده , , L. J. Pettersson، نويسنده , , M. and Rنsنnen، نويسنده , , M.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2004
Pages :
2
From page :
228
To page :
229
Abstract :
A recent computational study published in this journal suggests that a novel metastable molecule HKrSH exists and calculations at the MP2/6-311++G(2d,2p) level indicate a barrier high enough to trap this molecule in its local stable configuration. However, the report fails to present all factors influencing its stability and these inadequacies greatly affect the conclusions on the existence and experimental characterisation of such species.
Journal title :
Chemical Physics Letters
Serial Year :
2004
Journal title :
Chemical Physics Letters
Record number :
1783885
Link To Document :
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