{ "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" [ [ 0.003574 0.165709 0.25306 ] [ 0.003574 0.834291 0.75306 ] [ 0.495591 0.322803 0.254029 ] [ 0.495591 0.677197 0.754029 ] [ 0.022247 0.524447 0.494085 ] [ 0.022247 0.475553 0.994085 ] [ 0.514117 0.998057 0.512975 ] [ 0.514117 0.001943 0.012975 ] [ 0.261356 0.7008 0.465924 ] [ 0.261356 0.2992 0.965924 ] [ 0.64222 0.099179 0.148356 ] [ 0.64222 0.900821 0.648356 ] [ 0.135789 0.384635 0.155591 ] [ 0.222867 0.800485 0.041049 ] [ 0.135789 0.615365 0.655591 ] [ 0.222867 0.199515 0.541049 ] [ 0.354257 0.116885 0.350142 ] [ 0.354257 0.883115 0.850142 ] [ 0.727144 0.674482 0.03091 ] [ 0.727144 0.325518 0.53091 ] [ 0.766045 0.815536 0.451532 ] [ 0.854794 0.3866 0.342348 ] [ 0.766045 0.184464 0.951532 ] [ 0.854794 0.6134 0.842348 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "V" "V" "O" "O" "O" "O" "F" "F" "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" 5.38249275 "source-unit" "angstrom" } "b" { "source-value" 5.1167042 "source-unit" "angstrom" } "c" { "source-value" 12.35354792 "source-unit" "angstrom" } "beta" { "source-value" 108.45931174 "source-unit" "degree" } }