[ { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 4.019925951957703 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.019925951957703e-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" 696.716891871235 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725943036 "si-unit" "kg / m s^2" "si-value" 696716891871.235 } "c12" { "source-value" 748.9156590892056 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863626891965 "si-unit" "kg / m s^2" "si-value" 748915659089.2057 } "c44" { "source-value" 82.44587914072791 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813363344 "si-unit" "kg / m s^2" "si-value" 82445879140.7279 } "excess" { "source-value" 2.1874280164984424e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 21874.28016498442 } } { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 4.019925951957703 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.019925951957703e-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" 731.5160700165488 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579412386 "si-unit" "kg / m s^2" "si-value" 731516070016.5488 } } ]