{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.534514 2.228148 2.279478 ] [ 2.568469 4.258609 2.123082 ] [ 4.573888 5.069598 2.661577 ] [ 4.270042 3.378559 1.121613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.534514e-10 2.228148e-10 2.279478e-10 ] [ 2.568469e-10 4.258609e-10 2.123082e-10 ] [ 4.573888e-10 5.069598e-10 2.661577e-10 ] [ 4.270042e-10 3.378559e-10 1.121613e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1721183 -3.911673 0.4472142 ] [ -3.1890324 4.3540927 0.4668074 ] [ 1.3484065 0.9600102 0.8357862 ] [ 2.0127441 -1.4024299 -1.7498078 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.757639162718406e-10 -6.267191028814598e-09 7.165161357297753e-10 ] [ -5.109393154253714e-09 6.976025528735948e-09 7.47907902696434e-10 ] [ 2.160385369634755e-09 1.538105898169532e-09 1.339077109627273e-09 ] [ 3.224771540673137e-09 -2.246940398090882e-09 -2.803501148053482e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.997323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.761965380198612e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6410169 2.1224576 2.3015711 ] [ 2.3846221 4.4803146 2.1044169 ] [ 4.6240471 5.0185635 2.7038688 ] [ 4.2972268 3.3135783 1.0758932 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6410169e-10 2.1224576e-10 2.3015711e-10 ] [ 2.3846221e-10 4.4803146e-10 2.1044169e-10 ] [ 4.624047100000001e-10 5.0185635e-10 2.7038688e-10 ] [ 4.2972268e-10 3.3135783e-10 1.0758932e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.83e-05 2.9e-06 -3.63e-05 ] [ 2.68e-05 -4.57e-05 1.58e-05 ] [ 1.72e-05 3.56e-05 -2.76e-05 ] [ -1.57e-05 7.2e-06 4.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.534159836864e-14 4.646312200320001e-15 -5.815901133504e-14 ] [ 4.293833343744e-14 -7.321947157056e-14 2.531439060864e-14 ] [ 2.755743787776e-14 5.703748770048e-14 -4.422007473408001e-14 ] [ -2.515417294656e-14 1.153567166976e-14 7.706469546047999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.031003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927579173137467e-18 } }