[ { "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.56183634698391 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.56183634698391e-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" 232.57448173084003 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725186993 "si-unit" "kg / m s^2" "si-value" 232574481730.84 } "c12" { "source-value" 156.79607038050986 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362007187 "si-unit" "kg / m s^2" "si-value" 156796070380.5099 } "c44" { "source-value" 157.9577756030474 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681459336 "si-unit" "kg / m s^2" "si-value" 157957775603.0474 } "excess" { "source-value" 0.5788718058971981 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809136275 "si-unit" "kg / m s^2" "si-value" 578871805.8971981 } } { "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.56183634698391 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.56183634698391e-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" 182.0555408306199 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578895646 "si-unit" "kg / m s^2" "si-value" 182055540830.6199 } } ]