[ { "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" 3.84633120149374 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.84633120149374e-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" 1053.2737360823744 "source-unit" "GPa" "source-std-uncert-value" 0.007335930726523833 "si-unit" "kg / m s^2" "si-value" 1053273736082.374 } "c12" { "source-value" 850.5058342213069 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362806209 "si-unit" "kg / m s^2" "si-value" 850505834221.3069 } "c44" { "source-value" 299.60903127219603 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826816900723 "si-unit" "kg / m s^2" "si-value" 299609031272.196 } "excess" { "source-value" 0.0001518123404764872 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 151812.3404764872 } } { "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" 3.84633120149374 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.84633120149374e-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" 918.0951348416627 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579587853 "si-unit" "kg / m s^2" "si-value" 918095134841.6627 } } ]