In quantum chemistry one usually deals with many-electron systems, and the wave functions depend on the coordinates of all the electrons. Except for very special cases (like He, H2), the wave functions applied are constructed of one-electron functions as building blocks, requesting the many-electron wave functions to satisfy the Pauli principle (and trying, of course to get an approximation to the exact solution that is as good as possible).


Spin Orbital Slater Determinant Occupied Orbital Spin Function Symmetry Adapt Perturbation Theory 
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Copyright information

© Springer Science+Business Media New York 2003

Authors and Affiliations

  • István Mayer
    • 1
  1. 1.Chemical Research CenterHungarian Academy of SciencesBudapestHungary

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