{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.605308 0.351301 0.312321 ] [ 0.394692 0.648699 0.687679 ] [ 0.239753 0.028001 0.004256 ] [ 0.760247 0.971999 0.995744 ] [ 0.977191 0.70238 0.372371 ] [ 0.022809 0.29762 0.627629 ] [ 0.070034 0.7608 0.013609 ] [ 0.437995 0.216334 0.031058 ] [ 0.690753 0.861625 0.286269 ] [ 0.210795 0.880332 0.288992 ] [ 0.076849 0.390497 0.36642 ] [ 0.923151 0.609503 0.63358 ] [ 0.789205 0.119668 0.711008 ] [ 0.309247 0.138375 0.713731 ] [ 0.562005 0.783666 0.968942 ] [ 0.929966 0.2392 0.986391 ] ] } "species" { "source-value" [ "Cs" "Cs" "Ta" "Ta" "Ge" "Ge" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.06243972 "source-unit" "angstrom" } "b" { "source-value" 7.48602722 "source-unit" "angstrom" } "c" { "source-value" 9.54045012 "source-unit" "angstrom" } "alpha" { "source-value" 67.3480361 "source-unit" "degree" } "beta" { "source-value" 77.48155578 "source-unit" "degree" } "gamma" { "source-value" 74.8419019 "source-unit" "degree" } }