{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.589972 0.910028 0.089972 ] [ 0.182678 0.182678 0.182678 ] [ 0.317322 0.817322 0.682678 ] [ 0.682678 0.317322 0.817322 ] [ 0.910028 0.089972 0.589972 ] [ 0.089972 0.589972 0.910028 ] [ 0.410028 0.410028 0.410028 ] [ 0.327448 0.172552 0.827448 ] [ 0.172552 0.827448 0.327448 ] [ 0.827448 0.327448 0.172552 ] [ 0.672552 0.672552 0.672552 ] [ 0.817322 0.682678 0.317322 ] [ 0.038726 0.461274 0.538726 ] [ 0.461274 0.538726 0.038726 ] [ 0.961274 0.961274 0.961274 ] [ 0.538726 0.038726 0.461274 ] [ 0.259589 0.119456 0.502621 ] [ 0.740411 0.619456 0.997379 ] [ 0.380544 0.497379 0.759589 ] [ 0.997379 0.740411 0.619456 ] [ 0.497379 0.759589 0.380544 ] [ 0.119456 0.502621 0.259589 ] [ 0.502621 0.259589 0.119456 ] [ 0.619456 0.997379 0.740411 ] [ 0.880544 0.002621 0.240411 ] [ 0.002621 0.240411 0.880544 ] [ 0.240411 0.880544 0.002621 ] [ 0.759589 0.380544 0.497379 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Sb" "Sb" "Sb" "Sb" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.67837338 "source-unit" "angstrom" } }