{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0936271 -0.8267829 -0.2098655 ] [ 1.7736358 0.5274011 -1.4904027 ] [ -1.2385565 2.475022 -1.8702401 ] [ -0.9098582 -1.4443782 1.681526 ] [ 1.0476879 -4.7259844 -1.1196215 ] [ -0.9038485 0.6538285 4.4482649 ] [ 2.3245666 3.3408939 -1.439661 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.354360419929181e-09 -1.324652243770758e-09 -3.36241600382727e-10 ] [ 2.841677835985897e-09 8.449897191658972e-10 -2.387888381190511e-09 ] [ -1.984386284188821e-09 3.965422417035948e-09 -2.996454988189823e-09 ] [ -1.457753548293298e-09 -2.314149002698979e-09 2.694101666663484e-09 ] [ 1.678581073104528e-09 -7.571861778328509e-09 -1.793831406224031e-09 ] [ -1.448124947375949e-09 1.047548745343269e-09 7.126906084622346e-09 ] [ 3.724366290696824e-09 5.352702143253132e-09 -2.306591215081074e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.421158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.150306574882217e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4554986 0.6367656 2.8767098 ] [ 2.3288953 1.2627501 1.3621129 ] [ 2.7331217 3.5889448 2.1500969 ] [ 2.1456665 -0.0382624 4.5746992 ] [ 3.9715435 0.3933147 2.9786546 ] [ 2.5325858 2.165018 5.6661797 ] [ 4.2266926 2.6590354 3.9107768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.554986e-11 6.367656000000001e-11 2.8767098e-10 ] [ 2.3288953e-10 1.2627501e-10 1.3621129e-10 ] [ 2.7331217e-10 3.5889448e-10 2.1500969e-10 ] [ 2.1456665e-10 -3.82624e-12 4.574699200000001e-10 ] [ 3.9715435e-10 3.933147e-11 2.9786546e-10 ] [ 2.5325858e-10 2.165018e-10 5.6661797e-10 ] [ 4.2266926e-10 2.6590354e-10 3.9107768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 2.29e-05 3.61e-05 ] [ -9.9e-06 1.68e-05 -3.77e-05 ] [ 5e-07 6.3e-06 -4.95e-05 ] [ -2.44e-05 -4.5e-05 -5e-06 ] [ 3.52e-05 -1.5e-06 3.66e-05 ] [ 7.4e-06 -2.03e-05 1.17e-05 ] [ -6.5e-06 2.1e-05 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-15 3.66898449186e-14 5.783857648740001e-14 ] [ -1.58615486766e-14 2.691656745119999e-14 -6.040205910179999e-14 ] [ 8.010883169999999e-16 1.00937127942e-14 -7.930774338299999e-14 ] [ -3.909310986959999e-14 -7.209794852999999e-14 -8.010883169999999e-15 ] [ 5.63966175168e-14 -2.403264951e-15 5.86396648044e-14 ] [ 1.18561070916e-14 -3.252418567019999e-14 1.87454666178e-14 ] [ -1.0414148121e-14 3.364570931399999e-14 1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.049323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.052038020411878e-18 } }