{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -26.6620859 -15.2266989 -14.901233 ] [ -21.9876837 -6.7861324 20.2225945 ] [ -34.2609629 3.1460828 -9.2897398 ] [ 3.5078932 26.663664 6.6524677 ] [ 12.510354 -12.3886007 -25.0538003 ] [ 33.4111092 -7.9847184 27.5798482 ] [ 33.4813761 12.5764036 -5.2101374 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.271737069074133e-08 -2.439586098954108e-08 -2.387440713369345e-08 ] [ -3.522815276968525e-08 -1.087258267693339e-08 3.240016811981867e-08 ] [ -5.489211376447617e-08 5.040580309261001e-09 -1.488380392087527e-08 ] [ 5.620264473303298e-09 4.271989908566661e-08 1.065842821956715e-08 ] [ 2.004379669673176e-08 -1.984872640596652e-08 -4.014061310285203e-08 ] [ 5.353049803523579e-08 -1.279292914415158e-08 4.418778799125297e-08 ] [ 5.364307801963188e-08 2.014961982166496e-08 -8.347560333435698e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5033071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.010740110302648e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8052617 1.297831 2.8939229 ] [ 1.8236569 2.3042181 5.3126997 ] [ 2.2486156 3.6633672 1.7809912 ] [ 2.9233926 4.4216033 4.2306214 ] [ 4.0602352 1.6107992 1.4467104 ] [ 4.2439688 1.9319929 4.1580031 ] [ 4.9049221 3.9706304 2.4565083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8052617e-10 1.297831e-10 2.8939229e-10 ] [ 1.8236569e-10 2.3042181e-10 5.312699699999999e-10 ] [ 2.2486156e-10 3.6633672e-10 1.7809912e-10 ] [ 2.9233926e-10 4.4216033e-10 4.230621400000001e-10 ] [ 4.0602352e-10 1.6107992e-10 1.4467104e-10 ] [ 4.2439688e-10 1.9319929e-10 4.1580031e-10 ] [ 4.904922100000001e-10 3.9706304e-10 2.4565083e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -1.1e-06 -8.9e-06 ] [ -2.45e-05 -8.8e-06 3.38e-05 ] [ -2.5e-05 6e-07 -2.35e-05 ] [ 1.84e-05 1.01e-05 -9.2e-06 ] [ 1.24e-05 1.72e-05 4.4e-06 ] [ 1.68e-05 -2.16e-05 1.1e-05 ] [ 7.9e-06 3.7e-06 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.292624400640001e-15 -1.76239428288e-15 -1.425937192512e-14 ] [ -3.92533272096e-14 -1.409915426304e-14 5.415356978304e-14 ] [ -4.005441552e-14 9.6130597248e-16 -3.76511505888e-14 ] [ 2.948004982272e-14 1.618198387008e-14 -1.474002491136e-14 ] [ 1.986699009792e-14 2.755743787776e-14 7.04957713152e-15 ] [ 2.691656722944e-14 -3.460701500928e-14 1.76239428288e-14 ] [ 1.265719530432e-14 5.928053496960001e-15 -1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.952085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.997764722721437e-18 } }