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- W2071294512 abstract "The cluster variation method previously applied to calculate the thermal behavior of ferroand antiferromagnets near the Curie temperature is extended to a discussion of solid hydrogen near its order-disorder transition. An attempt is made to describe the relationship between the order-disorder transition and the crystallographic phase change. The orientational free energies of the orthohydrogen or paradeuterium systems are calculated for both the face-centered cubic (fcc) and the hexagonal close-packed (hcp) lattices. The space group $mathrm{Pa}3$ is assumed for the fcc case and $mathrm{Pca}{2}_{1}$ for the hcp case. Within the cluster variation approximation, a first-order transition is found to occur when the free energies for the fcc and hcp phases cross. The fcc-hcp crystallographic transition occurs near the onset of the orientational ordering in the cubic phase. This prediction is in good agreement with experiment except when repeated cycling is performed." @default.
- W2071294512 created "2016-06-24" @default.
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- W2071294512 date "1972-02-15" @default.
- W2071294512 modified "2023-09-26" @default.
- W2071294512 title "Cluster Expansion for Solid Orthohydrogen" @default.
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- W2071294512 doi "https://doi.org/10.1103/physrevb.5.1591" @default.
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