[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Ni" "Ni" ] } "a" { "source-value" 2.7943561598658557 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.794356159865856e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 195.14439834608325 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307251260235 "si-unit" "kg / m s^2" "si-value" 195144398346.0833 } "c12" { "source-value" 181.4911288077233 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362035632 "si-unit" "kg / m s^2" "si-value" 181491128807.7233 } "c44" { "source-value" 140.63345406378164 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814311162 "si-unit" "kg / m s^2" "si-value" 140633454063.7816 } "excess" { "source-value" 0.06413086121409123 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133313 "si-unit" "kg / m s^2" "si-value" 64130861.21409123 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Ni" "Ni" ] } "a" { "source-value" 2.7943561598658557 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.794356159865856e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 186.0422186538433 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578899395 "si-unit" "kg / m s^2" "si-value" 186042218653.8433 } } ]