{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1446516 0.7602583 1.64121 ] [ 0.5863284 2.091282 0.4918312 ] [ 1.988461 0.5220119 2.855455 ] [ 2.293973 2.837851 0.0455476 ] [ 2.215952 2.17866 2.777134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.446516e-11 7.602583e-11 1.64121e-10 ] [ 5.863284e-11 2.091282e-10 4.918312e-11 ] [ 1.988461e-10 5.220119e-11 2.855455e-10 ] [ 2.293973e-10 2.837851e-10 4.55476e-12 ] [ 2.215952e-10 2.17866e-10 2.777134e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.6879973 -16.6372263 10.3221026 ] [ 2.1472204 11.6061101 -4.785851 ] [ -3.2411067 -35.0440606 2.4371975 ] [ 7.3136149 2.883627 0.0210488 ] [ 3.4682686 37.1915498 -7.9944979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.552188290431509e-08 -2.665577523243027e-08 1.653783159947065e-08 ] [ 3.440226352928133e-09 1.85950384138514e-08 -7.667778646005533e-09 ] [ -5.192825423040847e-09 -5.614677505380002e-08 3.904820886943215e-09 ] [ 1.171770290285425e-08 4.620079800571518e-09 3.37238955337392e-11 ] [ 5.556778911355892e-09 5.958743207180736e-08 -1.280859773594207e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7464189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.400248188755983e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0578808 0.473147 1.5963264 ] [ 0.3774065 2.0008014 0.1015589 ] [ 1.6565162 0.6105723 3.0439857 ] [ 2.1735214 3.0823739 0.6253899 ] [ 2.964041 2.2231685 2.4439169 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.788080000000001e-12 4.73147e-11 1.5963264e-10 ] [ 3.774065e-11 2.0008014e-10 1.015589e-11 ] [ 1.6565162e-10 6.105723e-11 3.0439857e-10 ] [ 2.1735214e-10 3.0823739e-10 6.253899000000001e-11 ] [ 2.964041e-10 2.2231685e-10 2.4439169e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -6.6e-06 1.01e-05 ] [ 1.54e-05 9.4e-06 -6e-07 ] [ -1.31e-05 -9e-06 4.6e-06 ] [ -9.1e-06 3.8e-06 -4.3e-06 ] [ 3.2e-06 2.4e-06 -9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.767835882399999e-15 -1.05743657844e-14 1.61819840034e-14 ] [ 2.46735201636e-14 1.50604603596e-14 -9.613059803999998e-16 ] [ -2.09885139054e-14 -1.4419589706e-14 7.370012516399999e-15 ] [ -1.45798073694e-14 6.088271209199999e-15 -6.8893595262e-15 ] [ 5.1269652288e-15 3.845223921599999e-15 -1.57013310132e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.012367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924593372643268e-18 } }