Hartree Calculations for the Ground State of Solid He and other Noble Gas Crystals

Lewis H. Nosanow and Gordon L. Shaw
Phys. Rev. 128, 546 – Published 15 October 1962
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Abstract

A single-particle model in which the wave functions are spherically symmetric about each lattice site was used to calculate the ground-state energy E0 of solid He. The self-consistent Hartree equations (which yielded the best such wave functions) were solved numerically to an accuracy of better than 1%. The results were worse than could have been expected a priori: At the observed densities, the calculated values of E0 were approximately +34 and +14 cal/mole for He3 and He4, respectively, as compared with experimental values of -4.5 and -12 cal/mole. Previous calculations are discussed in the light of our results. In addition, we calculated E0 for the crystals of the other noble gas elements. The results for Ar, Kr, and Xe are within experimental error whereas E0 for Ne is definitely outside this error (being about 5% higher than experiment).

  • Received 6 June 1962

DOI:https://doi.org/10.1103/PhysRev.128.546

©1962 American Physical Society

Authors & Affiliations

Lewis H. Nosanow* and Gordon L. Shaw

  • University of California, San Diego, La Jolla, California

  • *Present Address: University of Minnesota, Minneapolis, Minnesota.
  • Present Address: Stanford University, Stanford, California.

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Issue

Vol. 128, Iss. 2 — October 1962

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