{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.0912e-13 2.8561763e-10 8.8293e-12 ] [ 2.1667492e-10 6.296218999999999e-11 3.1861752e-10 ] [ 1.1809665e-10 1.8948169e-10 1.6797816e-10 ] ] "source-value" [ [ 0.0040912 2.8561763 0.088293 ] [ 2.1667492 0.6296219 3.1861752 ] [ 1.1809665 1.8948169 1.6797816 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.99117925581952e-12 2.8134221461248e-13 6.15171735322368e-12 ] [ 8.987089319053441e-12 -5.35575600801024e-12 1.140493405750272e-11 ] [ -1.497826857487296e-11 5.07441379339776e-12 -1.75566514107264e-11 ] ] "source-value" [ [ 0.0037394 0.0001756 0.0038396 ] [ 0.0056093 -0.0033428 0.0071184 ] [ -0.0093487 0.0031672 -0.010958 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.055632677938534e-19 "source-value" -5.6520814 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.531010174204378e-08 -7.016440914648614e-09 -2.379165663384107e-08 ] [ 1.515732623183695e-09 -4.491020590478312e-09 3.275518562525032e-09 ] [ 2.379436895864242e-08 1.150746150512693e-08 2.051613807131604e-08 ] ] "source-value" [ [ -15.7973231 -4.379318 -14.8495842 ] [ 0.9460459 -2.8030746 2.0444179 ] [ 14.8512771 7.1823926 12.8051663 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.932138947631542e-21 "source-value" 0.018300972 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.10209e-11 2.139572e-10 6.780668e-11 ] [ 1.535127e-10 6.598691e-11 2.515065e-10 ] [ 1.506471e-10 2.581174e-10 1.761118e-10 ] ] "source-value" [ [ 0.310209 2.139572 0.6780668 ] [ 1.535127 0.6598691 2.515065 ] [ 1.506471 2.581174 1.761118 ] ] } "instance-id" 1 }