[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Pt" "Pt" "Pt" "Pt" ] } "a" { "source-value" 3.942211627960205 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.942211627960205e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "c11" { "source-value" 343.90723229438436 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725368344 "si-unit" "kg / m s^2" "si-value" 343907232294.3843 } "c12" { "source-value" 279.03404620968297 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362147984 "si-unit" "kg / m s^2" "si-value" 279034046209.683 } "c44" { "source-value" 56.40996351601816 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812939243 "si-unit" "kg / m s^2" "si-value" 56409963516.01816 } "excess" { "source-value" 5.55576325685677e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 55557.6325685677 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Pt" "Pt" "Pt" "Pt" ] } "a" { "source-value" 3.942211627960205 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.942211627960205e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "isothermal-bulk-modulus" { "source-value" 300.6584415712501 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015790071866 "si-unit" "kg / m s^2" "si-value" 300658441571.2501 } } ]