{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.2170709 -3.6746137 4.2443313 ] [ 13.4187632 -37.9628322 -21.8326996 ] [ 10.4833938 -5.4498876 15.129832 ] [ -3.8691989 -8.454509 5.4934845 ] [ 26.2689415 12.1429038 -0.1614597 ] [ -7.7205744 8.8006565 -26.9730901 ] [ -16.3642543 34.5982822 24.0996016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.559567157863601e-08 -5.887380160611385e-09 6.800168379789671e-09 ] [ 2.14992286790914e-08 -6.082316221019343e-08 -3.497984086806951e-08 ] [ 1.679624845299967e-08 -8.731682498707821e-09 2.424066310703171e-08 ] [ -6.199140018805078e-09 -1.354561666014319e-08 8.801532432627178e-09 ] [ 4.208748392446289e-08 1.945507657698348e-08 -2.586869565413818e-10 ] [ -1.236972380282699e-08 1.410020609199156e-08 -4.321565434895194e-08 ] [ -2.621842565628587e-08 5.543255886068079e-08 3.861181825411427e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.503665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.964613946211524e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.945809 2.6910504 3.7492072 ] [ 3.8676936 0.9626233 1.0433354 ] [ 5.548102 2.1434372 4.0700941 ] [ 3.5815956 1.0210085 3.3903249 ] [ 5.2566725 4.0212145 2.6636492 ] [ 4.9969675 2.9852743 0.5534372 ] [ 3.0750957 4.7136942 3.2593199 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.945809e-10 2.6910504e-10 3.7492072e-10 ] [ 3.8676936e-10 9.626233e-11 1.0433354e-10 ] [ 5.548102e-10 2.1434372e-10 4.0700941e-10 ] [ 3.5815956e-10 1.0210085e-10 3.3903249e-10 ] [ 5.2566725e-10 4.021214500000001e-10 2.6636492e-10 ] [ 4.9969675e-10 2.9852743e-10 5.534372e-11 ] [ 3.0750957e-10 4.7136942e-10 3.2593199e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 -3.71e-05 -2.38e-05 ] [ -1.47e-05 4.4e-05 2.25e-05 ] [ 1.21e-05 -2.44e-05 2.34e-05 ] [ 6.1e-06 1.62e-05 2.46e-05 ] [ -8.7e-06 2.1e-06 3.29e-05 ] [ -2.36e-05 4e-06 -3.73e-05 ] [ 2.32e-05 -4.8e-06 -4.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 -5.944075263168e-14 -3.813180357504e-14 ] [ -2.355199632576e-14 7.04957713152e-14 3.604897396800001e-14 ] [ 1.938633711168e-14 -3.909310954752e-14 3.749093292672001e-14 ] [ 9.77327738688e-15 2.595526125696e-14 3.941354487168e-14 ] [ -1.393893660096e-14 3.36457090368e-15 5.271161082432e-14 ] [ -3.781136825088e-14 6.4087064832e-15 -5.976118795584e-14 ] [ 3.717049760256e-14 -7.69044777984e-15 -6.761185339776e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }