[ { "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" [ "Sr" "Sr" "Sr" "Sr" ] } "a" { "source-value" 5.36352859139443 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.36352859139443e-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" 52.88278879327793 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724894292 "si-unit" "kg / m s^2" "si-value" 52882788793.27793 } "c12" { "source-value" 30.17195866773069 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863618613405 "si-unit" "kg / m s^2" "si-value" 30171958667.73069 } "c44" { "source-value" 30.234669068565832 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812512874 "si-unit" "kg / m s^2" "si-value" 30234669068.56583 } "excess" { "source-value" 0.030005383326136323 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133118 "si-unit" "kg / m s^2" "si-value" 30005383.32613632 } } { "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" [ "Sr" "Sr" "Sr" "Sr" ] } "a" { "source-value" 5.36352859139443 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.36352859139443e-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" 37.742235376246434 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578759927 "si-unit" "kg / m s^2" "si-value" 37742235376.24644 } } ]