{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.2566823 -12.8045266 1.5963159 ] [ -2.589311 4.5374643 -9.3292053 ] [ -8.3342262 7.8261522 3.3711894 ] [ 3.1074336 -6.4825683 -4.5051711 ] [ 3.3621619 -3.4201757 0.7496968 ] [ 13.5991011 11.5244741 -1.6764915 ] [ 3.1115228 -1.18082 9.7936657 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.963736982963317e-08 -2.051511315893172e-08 2.557580014391311e-09 ] [ -4.148533548180269e-09 7.269819219174637e-09 -1.494703462230345e-08 ] [ -1.335290237009883e-08 1.253887808566248e-08 5.40124084096878e-09 ] [ 4.978657464608379e-09 -1.03862193729992e-08 -7.218079809123819e-09 ] [ 5.386777191524507e-09 -5.479725545568275e-09 1.201146685648573e-09 ] [ 2.178816184631556e-08 1.846424297003512e-08 -2.686035486269924e-09 ] [ 4.985209085246154e-09 -1.891882197373056e-09 1.569118221647087e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.025547449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.093152550888034e-21 } "relaxed-configuration-positions" { "source-value" [ [ 1.4523662 1.5830768 2.6381441 ] [ 3.1541514 4.141613 1.2409534 ] [ 1.8589779 3.8522444 3.2772655 ] [ 3.5123848 1.6427757 1.4236449 ] [ 5.1142721 2.2510092 3.1475282 ] [ 5.3816985 4.3755613 2.0808988 ] [ 3.6094361 3.1793727 4.7174482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4523662e-10 1.5830768e-10 2.6381441e-10 ] [ 3.1541514e-10 4.141613e-10 1.2409534e-10 ] [ 1.8589779e-10 3.8522444e-10 3.2772655e-10 ] [ 3.5123848e-10 1.6427757e-10 1.4236449e-10 ] [ 5.1142721e-10 2.2510092e-10 3.1475282e-10 ] [ 5.3816985e-10 4.3755613e-10 2.0808988e-10 ] [ 3.6094361e-10 3.1793727e-10 4.7174482e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 3.4e-06 9.1e-06 ] [ 1.07e-05 8.2e-06 1.97e-05 ] [ -1.94e-05 -1.22e-05 -1.81e-05 ] [ -1.28e-05 3.1e-06 1.96e-05 ] [ -1.8e-05 3.44e-05 1.9e-06 ] [ 2.52e-05 -8.2e-06 -1.74e-05 ] [ 3.9e-06 -2.86e-05 -1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.666263685632e-14 5.44740051072e-15 1.457980724928e-14 ] [ 1.714328984256e-14 1.313784829056e-14 3.156287942976e-14 ] [ -3.108222644352e-14 -1.954655477376e-14 -2.899939683648e-14 ] [ -2.050786074624e-14 4.96674752448e-15 3.140266176767999e-14 ] [ -2.88391791744e-14 5.511487575552001e-14 3.04413557952e-15 ] [ 4.037485084416e-14 -1.313784829056e-14 -2.787787320192e-14 ] [ 6.24848882112e-15 -4.582225135488e-14 -2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }