{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9562776 -19.4040968 3.2876779 ] [ -27.7229314 18.1509981 -31.054647 ] [ -20.9454545 8.7232372 21.8915715 ] [ 4.549545 -10.0848638 -11.893912 ] [ 22.7893532 -36.931463 16.3336984 ] [ 30.2857653 39.5461883 1.4356111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.434953858011473e-08 -3.10887902407001e-08 5.26744066810084e-09 ] [ -4.441703254912222e-08 2.908110480000522e-08 -4.975502939059685e-08 ] [ -3.355831751193016e-08 1.397616669953285e-08 3.507416404987159e-08 ] [ 7.289174634277537e-09 -1.615773300431225e-08 -1.905614773625257e-08 ] [ 3.651256890019367e-08 -5.917072659054023e-08 2.616946970767837e-08 ] [ 4.85231451066959e-08 6.33599783360145e-08 2.300102540980971e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 28.182503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.515334742222587e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2111931 0.5650733 3.4197454 ] [ 1.4476101 3.0844793 0.9794727 ] [ -0.0312002 2.1991337 2.4515712 ] [ 2.3023976 1.0578521 0.1910499 ] [ 3.1891374 0.7940113 2.3366431 ] [ 3.2848093 3.1270286 2.4225166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2111931e-10 5.650733e-11 3.4197454e-10 ] [ 1.4476101e-10 3.0844793e-10 9.794727e-11 ] [ -3.12002e-12 2.1991337e-10 2.4515712e-10 ] [ 2.3023976e-10 1.0578521e-10 1.910499e-11 ] [ 3.1891374e-10 7.940113e-11 2.3366431e-10 ] [ 3.2848093e-10 3.1270286e-10 2.4225166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 1.82e-05 -4.9e-06 ] [ -2.36e-05 2.98e-05 1.34e-05 ] [ -1.87e-05 -2.93e-05 -2.24e-05 ] [ -1.08e-05 1.6e-06 3.7e-06 ] [ 1.75e-05 -2.22e-05 2.25e-05 ] [ 3.77e-05 1.9e-06 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 2.915961449856e-14 -7.850665441919999e-15 ] [ -3.781136825088e-14 4.774486329984001e-14 2.146916671872e-14 ] [ -2.996070280896e-14 -4.694377498944e-14 -3.588875630592e-14 ] [ -1.730350750464e-14 2.56348259328e-15 5.928053496960001e-15 ] [ 2.8038090864e-14 -3.556832098176e-14 3.604897396800001e-14 ] [ 6.040205860416e-14 3.04413557952e-15 -1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }