{ "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" [ [ 0.542887 0.235759 0.081012 ] [ 0.024696 0.742458 0.406745 ] [ 0.975304 0.257542 0.593255 ] [ 0.457113 0.764241 0.918988 ] [ 0 0.5 0 ] [ 0.495187 0.7461 0.242456 ] [ 0.988126 0.233666 0.25826 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0.011874 0.766334 0.74174 ] [ 0.504813 0.253899 0.757544 ] [ 0.66228 0.746045 0.412749 ] [ 0.33772 0.253955 0.587251 ] [ 0.29542 0.711886 0.075605 ] [ 0.182484 0.254602 0.091031 ] [ 0.709679 0.018254 0.179371 ] [ 0.757484 0.486187 0.164764 ] [ 0.225522 0.495675 0.332178 ] [ 0.218994 0.980174 0.329899 ] [ 0.787743 0.247041 0.430617 ] [ 0.212257 0.752959 0.569383 ] [ 0.781006 0.019826 0.670101 ] [ 0.774478 0.504325 0.667822 ] [ 0.242516 0.513813 0.835236 ] [ 0.290321 0.981746 0.820629 ] [ 0.817516 0.745398 0.908969 ] [ 0.70458 0.288114 0.924395 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "O" "O" "F" "F" "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" 5.1019115 "source-unit" "angstrom" } "b" { "source-value" 5.95271371 "source-unit" "angstrom" } "c" { "source-value" 10.50236427 "source-unit" "angstrom" } "alpha" { "source-value" 92.41002042 "source-unit" "degree" } "beta" { "source-value" 91.05269557 "source-unit" "degree" } "gamma" { "source-value" 90.96187927 "source-unit" "degree" } }