Title of article :
Visualization of two-body electron-densities and wavefuctions for several molecules
Author/Authors :
Yamaki، نويسنده , , D. and Nagao، نويسنده , , H. and Nakano، نويسنده , , Eamor M. and Yoshioka، نويسنده , , Y. and Yamaguchi، نويسنده , , K.، نويسنده ,
Issue Information :
دوماهنامه با شماره پیاپی سال 1999
Pages :
2
From page :
2002
To page :
2003
Abstract :
The purpose of this paper is to propose a visualization method of two-electron wavefuctions. This method is based on a simple idea that the two-electron wavefunction maps on the direct product of two-electron coordinates or basis-sets. The obtained graphical image helps us to understand many-body problems intuitively. As examples, we apply this method to H2 and H4.
Keywords :
Ab initio quantum chemical methods and calculations , computer simulations , Many-body and quasiparticle theories
Journal title :
Synthetic Metals
Serial Year :
1999
Journal title :
Synthetic Metals
Record number :
2072976
Link To Document :
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