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Gordon Gallup Publications
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Document Type
Article
Date of this Version
February 1969
Abstract
Calculations of the energy of H2 have been performed using both the projected Hartree–Fock (PHF) method and a full CI method in the same basis for comparison of the two methods. It is discovered that PHF can account for 86% of the correlation energy, whereas CI will account for 88% of the correlation energy. ©1969 American Institute of Physics
Comments
Published by American Institute of Physics. J. Chemical Physics 50, 1214 (1969). ©1969 American Institute of Physics. Permission to use. http://jcp.aip.org/.