{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1951315 0.9808283 -2.0288796 ] [ -8.7815882 -2.3797763 8.6864993 ] [ -3.8974755 -2.9636642 -0.4653572 ] [ 1.7697419 -1.1651163 -4.2479706 ] [ 14.2905454 -7.7929918 -6.8552728 ] [ 0.0124162 12.3478005 7.0001431 ] [ 2.8014916 0.9729198 -2.0891623 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.925694933857369e-09 1.571460184225942e-09 -3.250623488319266e-09 ] [ -1.406965542345012e-08 -3.812821982006974e-09 1.391730620971735e-08 ] [ -6.244444177687467e-09 -4.748313532262302e-09 -7.455844323036647e-10 ] [ 2.835439120390765e-09 -1.866722111752534e-09 -6.805999237238961e-09 ] [ 2.289597792699618e-08 -1.24857493709136e-08 -1.098335789985575e-08 ] [ 1.98929455230708e-11 1.978335744239352e-08 1.121546570947632e-08 ] [ 4.488484381867274e-09 1.558789370315953e-09 -3.347207021693698e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.088345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.417419380473073e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.81933 2.7941884 2.7284759 ] [ 2.887942 0.6538801 5.3594153 ] [ 1.5847389 0.3693707 3.3018414 ] [ 3.5962761 0.8055597 1.8781149 ] [ 4.9791764 1.1074953 4.0615696 ] [ 3.2021305 3.096129 4.911989 ] [ 4.3575131 3.1367792 2.6241869 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.81933e-10 2.7941884e-10 2.7284759e-10 ] [ 2.887942e-10 6.538801e-11 5.3594153e-10 ] [ 1.5847389e-10 3.693707e-11 3.3018414e-10 ] [ 3.5962761e-10 8.055597e-11 1.8781149e-10 ] [ 4.9791764e-10 1.1074953e-10 4.0615696e-10 ] [ 3.2021305e-10 3.096129e-10 4.911989000000001e-10 ] [ 4.357513100000001e-10 3.1367792e-10 2.6241869e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.35e-05 -3.23e-05 -2e-06 ] [ 1.3e-06 1.53e-05 4.12e-05 ] [ -2.61e-05 1.05e-05 -2.63e-05 ] [ 3.32e-05 2.1e-05 -2.9e-05 ] [ -1.68e-05 1.54e-05 -2.2e-06 ] [ 4.25e-05 -3.9e-06 4.6e-06 ] [ -2.06e-05 -2.59e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.162938455899999e-14 -5.17503052782e-14 -3.204353268e-15 ] [ 2.0828296242e-15 2.45133025002e-14 6.600967732079998e-14 ] [ -4.18168101474e-14 1.6822854657e-14 -4.21372454742e-14 ] [ 5.31922642488e-14 3.364570931399999e-14 -4.6463122386e-14 ] [ -2.691656745119999e-14 2.46735201636e-14 -3.5247885948e-15 ] [ 6.8092506945e-14 -6.248488872599999e-15 7.370012516399999e-15 ] [ -3.300483866039999e-14 -4.149637482059999e-14 2.19498198858e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.53667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450554944816878e-18 } }