{ "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" [ [ 0.989208 0.749859 0.995025 ] [ 0.989208 0.250141 0.495025 ] [ 0.352469 0.271684 0.834867 ] [ 0.666968 0.737957 0.677123 ] [ 0.352469 0.728316 0.334867 ] [ 0.666968 0.262043 0.177123 ] [ 0.616622 0.549053 0.821196 ] [ 0.616622 0.450947 0.321196 ] [ 0.30338 0.446748 0.999368 ] [ 0.038503 0.958943 0.829675 ] [ 0.970424 0.449404 0.668285 ] [ 0.369139 0.052613 0.669421 ] [ 0.693289 0.934057 0.505041 ] [ 0.30338 0.553252 0.499368 ] [ 0.038503 0.041057 0.329675 ] [ 0.369139 0.947387 0.169421 ] [ 0.970424 0.550596 0.168285 ] [ 0.693289 0.065943 0.005041 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "V" "V" "O" "O" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.71782214 "source-unit" "angstrom" } "b" { "source-value" 4.71800236 "source-unit" "angstrom" } "c" { "source-value" 10.43805111 "source-unit" "angstrom" } "beta" { "source-value" 116.11640975 "source-unit" "degree" } }