{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9150383 -8.3133631 -6.4839694 ] [ -1.2799444 -3.4384564 15.1375917 ] [ -11.3982133 11.4840987 -3.8842217 ] [ 0.8106743 -5.3651689 -3.8805526 ] [ 10.0513493 -3.6164002 5.1313592 ] [ 4.6250198 1.1954492 -10.8094859 ] [ 6.1061526 8.0538406 4.7892787 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.428346593779658e-08 -1.331947599904141e-08 -1.03884641826626e-08 ] [ -2.050696993603884e-09 -5.509014455720134e-09 2.425309551695613e-08 ] [ -1.826195086815162e-08 1.839955444809968e-08 -6.223209197744031e-09 ] [ 1.298843410543405e-09 -8.595948178223252e-09 -6.217330651504654e-09 ] [ 1.610403685595445e-08 -5.794111851896445e-09 8.221343743166993e-09 ] [ 7.410098594297091e-09 1.915320759594064e-09 -1.731870559184725e-08 ] [ 9.783134938757133e-09 1.290367511696984e-08 7.673270363635417e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.515103 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684705219190394e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6390032 1.8921467 2.5517112 ] [ 2.5083092 3.0173736 4.6083026 ] [ 1.8055614 4.3832958 2.4183032 ] [ 3.8802929 1.6084127 1.6555252 ] [ 4.7539435 2.2361286 3.8349206 ] [ 3.8643162 3.9653356 1.0624922 ] [ 4.2661627 4.6550189 3.4319201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6390032e-10 1.8921467e-10 2.5517112e-10 ] [ 2.5083092e-10 3.0173736e-10 4.6083026e-10 ] [ 1.8055614e-10 4.3832958e-10 2.4183032e-10 ] [ 3.8802929e-10 1.6084127e-10 1.6555252e-10 ] [ 4.7539435e-10 2.2361286e-10 3.8349206e-10 ] [ 3.864316200000001e-10 3.9653356e-10 1.0624922e-10 ] [ 4.2661627e-10 4.6550189e-10 3.4319201e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.47e-05 2.13e-05 1.42e-05 ] [ -2.8e-06 -1.17e-05 -2.1e-05 ] [ 3e-05 -9e-07 -2.01e-05 ] [ -3e-07 8.4e-06 3.37e-05 ] [ -1.06e-05 1.79e-05 -3.81e-05 ] [ -2.69e-05 -3e-06 3.19e-05 ] [ -1.4e-05 -3.2e-05 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.957376253376001e-14 3.412636202304e-14 2.275090801536e-14 ] [ -4.48609453824e-15 -1.874546646336e-14 -3.36457090368e-14 ] [ 4.8065298624e-14 -1.44195895872e-15 -3.220375007808e-14 ] [ -4.8065298624e-16 1.345828361472e-14 5.399335212096e-14 ] [ -1.698307218048e-14 2.867896151232001e-14 -6.104292925248e-14 ] [ -4.309855109952001e-14 -4.8065298624e-15 5.110943420352001e-14 ] [ -2.24304726912e-14 -5.12696518656e-14 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }