{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2675991 1.2794807 0.0430398 ] [ -2.2320607 2.4783561 -0.1284284 ] [ -0.000839 -1.1504309 -0.7373039 ] [ 0.5534834 -1.8896332 0.3101016 ] [ 0.4118172 -0.7177727 0.5125908 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.030917642567121e-09 2.049954064304819e-09 6.895736132390784e-11 ] [ -3.576155469746482e-09 3.970764201437067e-09 -2.057649799267507e-10 ] [ -1.3442261848512e-12 -1.843193491825903e-09 -1.181291071004661e-09 ] [ 8.867781634808946e-10 -3.027526134927491e-09 4.968375335926733e-10 ] [ 6.598038898833177e-10 -1.149998638988492e-09 8.212609957971686e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.407562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.269651872392649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6025977 1.9276985 2.2253815 ] [ 2.8623489 4.160813 1.1436261 ] [ 2.6047312 3.9252696 3.4725617 ] [ 4.1604735 2.3043662 0.5000097 ] [ 4.6828447 3.2559508 2.5898364 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6025977e-10 1.9276985e-10 2.2253815e-10 ] [ 2.8623489e-10 4.160813e-10 1.1436261e-10 ] [ 2.6047312e-10 3.9252696e-10 3.4725617e-10 ] [ 4.1604735e-10 2.3043662e-10 5.000097e-11 ] [ 4.6828447e-10 3.2559508e-10 2.5898364e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.89e-05 -2.9e-06 -3.1e-06 ] [ 1.66e-05 -1.42e-05 4.97e-05 ] [ -6.9e-06 1.56e-05 -3.5e-05 ] [ -9.4e-06 1.01e-05 1.19e-05 ] [ -1.92e-05 -8.6e-06 -2.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.028113813312e-14 -4.646312200320001e-15 -4.96674752448e-15 ] [ 2.659613190528e-14 -2.275090801536e-14 7.962817805376001e-14 ] [ -1.105501868352e-14 2.499395528448e-14 -5.6076181728e-14 ] [ -1.506046023552e-14 1.618198387008e-14 1.906590178752e-14 ] [ -3.076179111936e-14 -1.377871893888e-14 -3.76511505888e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }