{ "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" [ [ 0.866185 0.800258 0.780544 ] [ 0.133815 0.199742 0.219456 ] [ 0.192884 0.819701 0.417758 ] [ 0.807116 0.180299 0.582242 ] [ 0.762642 0.488206 0.998639 ] [ 0.237358 0.511794 0.001361 ] [ 0.572543 0.926722 0.14645 ] [ 0.427457 0.073278 0.85355 ] [ 0.662077 0.518376 0.339452 ] [ 0.337923 0.481624 0.660548 ] [ 0.709083 0.005492 0.998922 ] [ 0.290917 0.994508 0.001078 ] [ 0.011868 0.676085 0.044838 ] [ 0.988132 0.323915 0.955162 ] [ 0.531045 0.672985 0.046143 ] [ 0.468955 0.327015 0.953857 ] [ 0.870521 0.486567 0.223909 ] [ 0.129479 0.513433 0.776091 ] [ 0.610196 0.323762 0.386154 ] [ 0.389804 0.676238 0.613846 ] [ 0.879939 0.988826 0.300865 ] [ 0.120061 0.011174 0.699135 ] [ 0.349778 0.534142 0.232871 ] [ 0.650222 0.465858 0.767129 ] [ 0.578189 0.027399 0.694789 ] [ 0.421811 0.972601 0.305211 ] [ 0.812104 0.722059 0.495702 ] [ 0.187896 0.277941 0.504298 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "O" "O" "O" "O" "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" 5.8032515 "source-unit" "angstrom" } "b" { "source-value" 7.8083582 "source-unit" "angstrom" } "c" { "source-value" 8.90980046 "source-unit" "angstrom" } "alpha" { "source-value" 107.93278312 "source-unit" "degree" } "beta" { "source-value" 108.32727762 "source-unit" "degree" } "gamma" { "source-value" 91.42259378 "source-unit" "degree" } }