Title of article :
Effects of finite basis set expansion and electron correlation on the atomic shell structure from average local electrostatic potential functions
Author/Authors :
De Proft، نويسنده , , F. and Sen، نويسنده , , K.D. and Geerlings، نويسنده , , P.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 1995
Pages :
5
From page :
154
To page :
158
Abstract :
The shell structure of a selected number of atoms is studied using the average local electrostatic potential function V(r)/ϱ(r) and Gaussian type orbitals. In addition, the influence of electron correlation on this function is discussed: these effects are shown to be small and can be neglected in comparison with the effect associated with basis set extension.
Journal title :
Chemical Physics Letters
Serial Year :
1995
Journal title :
Chemical Physics Letters
Record number :
1775425
Link To Document :
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