{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.663579 0.333047 0.33053 ] [ 0.686128 0.361839 0.838743 ] [ 0.349415 0.645522 0.169545 ] [ 0.325842 0.68679 0.659364 ] [ 0.00332 0.999654 0.501876 ] [ 0.999687 0.98829 0.999081 ] [ 0.899429 0.652354 0.911983 ] [ 0.515185 0.473859 0.219979 ] [ 0.202072 0.81123 0.564038 ] [ 0.869573 0.139244 0.883758 ] [ 0.936037 0.465173 0.718644 ] [ 0.803306 0.201004 0.447226 ] [ 0.733874 0.66484 0.419464 ] [ 0.731717 0.872572 0.617607 ] [ 0.39708 0.190871 0.947637 ] [ 0.598455 0.798361 0.050576 ] [ 0.460092 0.524786 0.774833 ] [ 0.267128 0.124608 0.384101 ] [ 0.598737 0.998983 0.246334 ] [ 0.267136 0.345498 0.581559 ] [ 0.417724 0.004936 0.756409 ] [ 0.072194 0.330057 0.08187 ] [ 0.062689 0.537234 0.280099 ] [ 0.139603 0.849246 0.114741 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "V" "V" "O" "O" "O" "F" "F" "F" "F" "F" "F" "F" "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" 5.26460783 "source-unit" "angstrom" } "b" { "source-value" 5.43438079 "source-unit" "angstrom" } "c" { "source-value" 12.95216476 "source-unit" "angstrom" } "alpha" { "source-value" 91.18251734 "source-unit" "degree" } "beta" { "source-value" 90.73763798 "source-unit" "degree" } "gamma" { "source-value" 118.88845046 "source-unit" "degree" } }