[ { "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" [ "Te" "Te" "Te" "Te" ] } "a" { "source-value" 5.1420004069805145 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.142000406980514e-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" 309.97373216930134 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725313069 "si-unit" "kg / m s^2" "si-value" 309973732169.3013 } "c12" { "source-value" 297.031899681102 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362168714 "si-unit" "kg / m s^2" "si-value" 297031899681.102 } "c44" { "source-value" 61.08856654427484 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813015456 "si-unit" "kg / m s^2" "si-value" 61088566544.27484 } "excess" { "source-value" 1.567942072474546e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 15679.42072474546 } } { "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" [ "Te" "Te" "Te" "Te" ] } "a" { "source-value" 5.1420004069805145 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.142000406980514e-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" 301.3458438438351 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579007834 "si-unit" "kg / m s^2" "si-value" 301345843843.8351 } } ]