{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.785436 0.834213 0.552866 ] [ 0.996881 0.003392 0.001339 ] [ 0.494871 0.489852 0.504967 ] [ 0.749332 0.130939 0.268064 ] [ 0.752939 0.361434 0.765876 ] [ 0.24045 0.644516 0.242197 ] [ 0.263908 0.866685 0.734277 ] [ 0.635993 0.08733 0.13164 ] [ 0.620947 0.175907 0.417501 ] [ 0.497843 0.378584 0.753465 ] [ 0.007393 0.110717 0.242648 ] [ 0.890201 0.294638 0.910046 ] [ 0.865668 0.417626 0.630211 ] [ 0.10645 0.62257 0.382912 ] [ 0.114117 0.710928 0.094515 ] [ 0.003122 0.886531 0.748928 ] [ 0.50568 0.589329 0.253523 ] [ 0.413857 0.799647 0.593691 ] [ 0.362158 0.921592 0.870193 ] ] } "species" { "source-value" [ "Li" "Cr" "Cr" "C" "C" "C" "C" "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" 5.17864818 "source-unit" "angstrom" } "b" { "source-value" 6.55048575 "source-unit" "angstrom" } "c" { "source-value" 7.66545558 "source-unit" "angstrom" } "alpha" { "source-value" 88.75816158 "source-unit" "degree" } "beta" { "source-value" 88.34681087 "source-unit" "degree" } "gamma" { "source-value" 67.2123853 "source-unit" "degree" } }