{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.239744 0.75 0.076384 ] [ 0.745731 0.987177 0.276957 ] [ 0.745731 0.512823 0.276957 ] [ 0.254269 0.487177 0.723043 ] [ 0.254269 0.012823 0.723043 ] [ 0.760256 0.25 0.923616 ] [ 0.233451 0.25 0.355773 ] [ 0.766549 0.75 0.644227 ] [ 0.279631 0.75 0.425335 ] [ 0.720369 0.25 0.574665 ] [ 0.261905 0.25 0.085971 ] [ 0.738095 0.75 0.914029 ] [ 0.740702 0.75 0.046522 ] [ 0.06297 0.25 0.156529 ] [ 0.459669 0.25 0.155466 ] [ 0.2418 0.933689 0.332206 ] [ 0.2418 0.566311 0.332206 ] [ 0.545152 0.75 0.476635 ] [ 0.892012 0.25 0.45189 ] [ 0.107988 0.75 0.54811 ] [ 0.454848 0.25 0.523365 ] [ 0.7582 0.433689 0.667794 ] [ 0.7582 0.066311 0.667794 ] [ 0.540331 0.75 0.844534 ] [ 0.93703 0.75 0.843471 ] [ 0.259298 0.25 0.953478 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "Co" "Co" "P" "P" "C" "C" "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" 5.63801406 "source-unit" "angstrom" } "b" { "source-value" 6.85915649 "source-unit" "angstrom" } "c" { "source-value" 9.74411134 "source-unit" "angstrom" } "beta" { "source-value" 90.10935212 "source-unit" "degree" } }