{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.018998 0.932894 0.75 ] [ 0.518998 0.567106 0.25 ] [ 0.481002 0.432894 0.75 ] [ 0.981002 0.067106 0.25 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.689002 0.307111 0.441013 ] [ 0.189002 0.192889 0.558987 ] [ 0.810998 0.807111 0.058987 ] [ 0.310998 0.692889 0.941013 ] [ 0.310998 0.692889 0.558987 ] [ 0.810998 0.807111 0.441013 ] [ 0.189002 0.192889 0.941013 ] [ 0.689002 0.307111 0.058987 ] [ 0.11638 0.454828 0.25 ] [ 0.61638 0.045172 0.75 ] [ 0.88362 0.545172 0.75 ] [ 0.38362 0.954828 0.25 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "V" "V" "V" "V" "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" 5.43985885 "source-unit" "angstrom" } "b" { "source-value" 5.80571001 "source-unit" "angstrom" } "c" { "source-value" 7.82034529 "source-unit" "angstrom" } }