{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5002647 -0.3871158 -0.2836723 ] [ 1.99896 -1.0858588 2.7530862 ] [ -2.1779563 0.6371495 1.4228533 ] [ 4.8590559 2.9132979 -1.3618978 ] [ -3.5310438 -5.2350517 -1.1450257 ] [ -6.097797 -1.8859364 2.6206926 ] [ 6.4490459 5.0435153 -4.0060365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.403689027351526e-09 -6.202278843022887e-10 -4.544931270285638e-10 ] [ 3.202686977914368e-09 -1.739737582849943e-09 4.410930344687112e-09 ] [ -3.489470664984071e-09 1.02082603285441e-09 2.279662292088129e-09 ] [ 7.785065762140303e-09 4.667617784805736e-09 -2.182000815078954e-09 ] [ -5.657355823380791e-09 -8.387477442419295e-09 -1.834533406755154e-09 ] [ -9.769747791784379e-09 -3.021603208395718e-09 4.198812414023567e-09 ] [ 1.03325105674461e-08 8.080602300307098e-09 -6.418378022371458e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.26183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.406520694142407e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1562571 0.5862623 1.3552557 ] [ 2.0124071 0.8348728 2.2286456 ] [ 2.3414318 3.0899104 3.0622591 ] [ 1.9072288 0.2198066 4.6472157 ] [ 4.1898897 0.6487496 3.5157114 ] [ 3.2422954 2.22898 5.2645654 ] [ 4.8570082 3.0589843 3.4455771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.562571e-11 5.862623e-11 1.3552557e-10 ] [ 2.0124071e-10 8.348728e-11 2.2286456e-10 ] [ 2.3414318e-10 3.0899104e-10 3.0622591e-10 ] [ 1.9072288e-10 2.198066e-11 4.6472157e-10 ] [ 4.1898897e-10 6.487496000000001e-11 3.5157114e-10 ] [ 3.2422954e-10 2.22898e-10 5.264565400000001e-10 ] [ 4.8570082e-10 3.0589843e-10 3.4455771e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.75e-05 -2.7e-06 -1.18e-05 ] [ 4.7e-06 3.8e-06 4.13e-05 ] [ 7.81e-05 -2.68e-05 5.78e-05 ] [ 4.51e-05 6.97e-05 -2.35e-05 ] [ 1.92e-05 -2.1e-05 -4.9e-06 ] [ -3.89e-05 -8.7e-06 -7.25e-05 ] [ -9.07e-05 -1.41e-05 1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8038090864e-14 -4.32587687616e-15 -1.890568412544e-14 ] [ 7.53023011776e-15 6.08827115904e-15 6.616989443904001e-14 ] [ 1.2512999408448e-13 -4.293833343744e-14 9.260580868224001e-14 ] [ 7.225816559807999e-14 1.1167171046976e-13 -3.76511505888e-14 ] [ 3.076179111936e-14 -3.36457090368e-14 -7.850665441919999e-15 ] [ -6.232467054911999e-14 -1.393893660096e-14 -1.16157805008e-13 ] [ -1.4531741950656e-13 -2.259069035328e-14 2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.386205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.746883090023607e-18 } }