{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.293752 0.998737 0.853027 ] [ 0.800717 0.498674 0.850448 ] [ 0.204614 0.497796 0.646658 ] [ 0.293752 0.001263 0.353027 ] [ 0.800717 0.501326 0.350448 ] [ 0.204614 0.502204 0.146658 ] [ 0.700265 0.998453 0.649341 ] [ 0.700265 0.001547 0.149341 ] [ 0.645767 0.834658 0.897259 ] [ 0.853075 0.63617 0.59522 ] [ 0.153204 0.657605 0.90317 ] [ 0.337624 0.846061 0.594602 ] [ 0.499285 0.311185 0.754196 ] [ 0.011697 0.200972 0.756077 ] [ 0.499285 0.688815 0.254196 ] [ 0.645767 0.165342 0.397259 ] [ 0.853075 0.36383 0.09522 ] [ 0.153204 0.342395 0.40317 ] [ 0.011697 0.799028 0.256077 ] [ 0.337624 0.153939 0.094602 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Al" "Al" "Cr" "Cr" "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" 5.24148363 "source-unit" "angstrom" } "b" { "source-value" 4.87519992 "source-unit" "angstrom" } "c" { "source-value" 7.17810008 "source-unit" "angstrom" } "beta" { "source-value" 95.70325582 "source-unit" "degree" } }