{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_12_12_1" } "basis-atom-coordinates" { "source-value" [ [ 0.27392 0.974677 0.624015 ] [ 0.77392 0.525323 0.375985 ] [ 0.72608 0.474677 0.875985 ] [ 0.22608 0.025323 0.124015 ] [ 0.405355 0.746199 0.785274 ] [ 0.905355 0.753801 0.214726 ] [ 0.594645 0.246199 0.714726 ] [ 0.094645 0.253801 0.285274 ] [ 0.965555 0.12701 0.969269 ] [ 0.465555 0.37299 0.030731 ] [ 0.034445 0.62701 0.530731 ] [ 0.534445 0.87299 0.469269 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.97134296 "source-unit" "angstrom" } "b" { "source-value" 5.23964378 "source-unit" "angstrom" } "c" { "source-value" 8.24597096 "source-unit" "angstrom" } }