[ { "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" [ "Sb" "Sb" "Sb" "Sb" ] } "a" { "source-value" 3.823230125010014 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.823230125010014e-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" 3366.947101157112 "source-unit" "GPa" "source-std-uncert-value" 0.007335930730292585 "si-unit" "kg / m s^2" "si-value" 3366947101157.112 } "c12" { "source-value" 1920.9915182097336 "source-unit" "GPa" "source-std-uncert-value" 0.005187286364039204 "si-unit" "kg / m s^2" "si-value" 1920991518209.734 } "c44" { "source-value" 1924.9841873975959 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826843376524 "si-unit" "kg / m s^2" "si-value" 1924984187397.596 } "excess" { "source-value" 1.9103858027358873 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809143942 "si-unit" "kg / m s^2" "si-value" 1910385802.735887 } } { "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" [ "Sb" "Sb" "Sb" "Sb" ] } "a" { "source-value" 3.823230125010014 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.823230125010014e-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" 2402.976712525526 "source-unit" "GPa" "source-std-uncert-value" 0.004235401580984308 "si-unit" "kg / m s^2" "si-value" 2402976712525.526 } } ]