{ "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" [ [ 0.340007 0.75 0.672509 ] [ 0.659993 0.25 0.327491 ] [ 0.2724 0.75 0.136217 ] [ 0.870744 0.75 0.144176 ] [ 0.858134 0.75 0.696484 ] [ 0.7276 0.25 0.863783 ] [ 0.129256 0.25 0.855824 ] [ 0.141866 0.25 0.303516 ] [ 0.390287 0.75 0.083135 ] [ 0.9164 0.75 0.310862 ] [ 0.685661 0.75 0.595058 ] [ 0.609713 0.25 0.916865 ] [ 0.0836 0.25 0.689138 ] [ 0.314339 0.25 0.404942 ] ] } "species" { "source-value" [ "Sm" "Sm" "H" "H" "H" "H" "H" "H" "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" 6.41361726544 "source-unit" "angstrom" } "b" { "source-value" 3.63502196 "source-unit" "angstrom" } "c" { "source-value" 6.4998311167 "source-unit" "angstrom" } "beta" { "source-value" 118.96239622 "source-unit" "degree" } }