{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnma" } "basis-atom-coordinates" { "source-value" [ [ 0.979583 0.064537 0.25 ] [ 0.479583 0.435463 0.75 ] [ 0.520417 0.564537 0.25 ] [ 0.020417 0.935463 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.634678 0.062248 0.75 ] [ 0.187381 0.190491 0.56838 ] [ 0.187381 0.190491 0.93162 ] [ 0.687381 0.309509 0.43162 ] [ 0.687381 0.309509 0.06838 ] [ 0.134678 0.437752 0.25 ] [ 0.865322 0.562248 0.75 ] [ 0.312619 0.690491 0.93162 ] [ 0.312619 0.690491 0.56838 ] [ 0.812619 0.809509 0.06838 ] [ 0.812619 0.809509 0.43162 ] [ 0.365322 0.937752 0.25 ] ] } "species" { "source-value" [ "Sm" "Sm" "Sm" "Sm" "In" "In" "In" "In" "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" 5.62297265 "source-unit" "angstrom" } "b" { "source-value" 5.95257063 "source-unit" "angstrom" } "c" { "source-value" 8.2389166 "source-unit" "angstrom" } }