{ "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" [ [ 1.463501 2.539158 2.160753 ] [ 0.2382428 1.617471 2.877509 ] [ 1.691566 0.7573037 1.355751 ] [ 1.857 2.738979 0.0220673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.463501e-10 2.539158e-10 2.160753e-10 ] [ 2.382428e-11 1.617471e-10 2.877509e-10 ] [ 1.691566e-10 7.573037e-11 1.355751e-10 ] [ 1.857e-10 2.738979e-10 2.20673e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.8896019 17.8301505 -3.9246649 ] [ -15.5029857 -10.7979016 9.0870169 ] [ 1.5182057 -6.8889296 -3.7945611 ] [ 0.0951782 -0.1433194 -1.3677908 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2253595619742e-08 2.856705051180341e-08 -6.288006399059946e-09 ] [ -2.483852144577613e-08 -1.730014563975121e-08 1.455900614994311e-08 ] [ 2.432433698145614e-09 -1.103728203839096e-08 -6.079557130705337e-09 ] [ 1.524922881061788e-10 -2.296229938788996e-10 -2.191442459960167e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7895911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.071594312834357e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.34728 3.4091621 2.2515896 ] [ 0.5227901 1.3620453 2.9196167 ] [ 1.2778753 0.4172936 0.9564507 ] [ 2.1023644 2.4644107 0.2884233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.34728e-10 3.4091621e-10 2.2515896e-10 ] [ 5.227901e-11 1.3620453e-10 2.9196167e-10 ] [ 1.2778753e-10 4.172936e-11 9.564507e-11 ] [ 2.1023644e-10 2.4644107e-10 2.884233e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -1.1e-06 6e-07 ] [ -3e-07 6e-07 1.2e-06 ] [ 7e-07 1.9e-06 -8e-07 ] [ 3e-07 -1.5e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1215236438e-15 -1.7623942974e-15 9.613059803999998e-16 ] [ -4.806529901999999e-16 9.613059803999998e-16 1.9226119608e-15 ] [ 1.1215236438e-15 3.0441356046e-15 -1.2817413072e-15 ] [ 4.806529901999999e-16 -2.403264951e-15 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886765150656e-18 } }