{ "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" [ [ 0.514723 0.792448 0.086513 ] [ 0.485277 0.207552 0.913487 ] [ 0.42997 0.212659 0.41794 ] [ 0.57003 0.787341 0.58206 ] [ 0.037977 0.349842 0.641174 ] [ 0.962023 0.650158 0.358826 ] [ 0.852297 0.797865 0.868528 ] [ 0.147703 0.202135 0.131472 ] [ 0.288941 0.445628 0.560356 ] [ 0.711059 0.554372 0.439644 ] [ 0.622936 0.953224 0.783228 ] [ 0.377064 0.046776 0.216772 ] [ 0.760942 0.116057 0.541372 ] [ 0.239058 0.883943 0.458628 ] [ 0.311688 0.425528 0.067248 ] [ 0.688312 0.574472 0.932752 ] [ 0.905601 0.623811 0.714735 ] [ 0.094399 0.376189 0.285265 ] [ 0.208405 0.926151 0.962084 ] [ 0.791595 0.073849 0.037916 ] [ 0.182699 0.235048 0.765933 ] [ 0.817301 0.764952 0.234067 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "V" "V" "V" "V" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.04397646519 "source-unit" "angstrom" } "b" { "source-value" 5.49359174428 "source-unit" "angstrom" } "c" { "source-value" 10.6892606026 "source-unit" "angstrom" } "alpha" { "source-value" 101.704106035 "source-unit" "degree" } "beta" { "source-value" 101.936504794 "source-unit" "degree" } "gamma" { "source-value" 98.7483057231 "source-unit" "degree" } }