[ { "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" 3.518474650382997 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.518474650382997e-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" 243.08269365515545 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072520411 "si-unit" "kg / m s^2" "si-value" 243082693655.1555 } "c12" { "source-value" 139.32288934214645 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361987064 "si-unit" "kg / m s^2" "si-value" 139322889342.1465 } "c44" { "source-value" 119.75527257360038 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813971079 "si-unit" "kg / m s^2" "si-value" 119755272573.6004 } "excess" { "source-value" 0.4757125235955666 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913568 "si-unit" "kg / m s^2" "si-value" 475712523.5955666 } } { "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" 3.518474650382997 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.518474650382997e-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" 173.9094907798161 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578887987 "si-unit" "kg / m s^2" "si-value" 173909490779.8161 } } ]