{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8790261 -0.2177676 0.0977325 ] [ 0.8433217 -0.3198768 -0.0639665 ] [ 1.1702013 1.1902857 0.7770525 ] [ -0.0567854 -0.3945754 0.0390828 ] [ -0.1880321 -0.1311281 -0.4211682 ] [ -0.2840903 1.0554618 -0.289003 ] [ -0.6055891 -1.1823995 -0.13973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.408355066493003e-09 -3.489021574877261e-10 1.56584726592336e-10 ] [ 1.351150311553311e-09 -5.124991304963175e-10 -1.024856308144032e-10 ] [ 1.874869164489767e-09 1.907047920612563e-09 1.244975348634192e-09 ] [ -9.098024028277632e-11 -6.321794810228084e-10 6.261754843540224e-11 ] [ -3.012606345799277e-10 -2.100903761499245e-10 -6.747858434644185e-10 ] [ -4.551628368560583e-10 1.691036220107485e-09 -4.630338499410624e-10 ] [ -9.702606978313133e-10 -1.894412835345609e-09 -2.23872139224384e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.871117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.504139232818144e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3621716 1.980969 1.0198466 ] [ 2.5246572 3.496834 2.6770819 ] [ 5.5835884 2.6776274 1.3832635 ] [ 3.1526996 1.1845528 3.2709692 ] [ 5.5332285 1.4398349 3.3876169 ] [ 4.169812 3.0867968 4.4712729 ] [ 4.7044267 4.4912892 2.6038417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3621716e-10 1.980969e-10 1.0198466e-10 ] [ 2.5246572e-10 3.496834e-10 2.6770819e-10 ] [ 5.5835884e-10 2.6776274e-10 1.3832635e-10 ] [ 3.1526996e-10 1.1845528e-10 3.2709692e-10 ] [ 5.5332285e-10 1.4398349e-10 3.3876169e-10 ] [ 4.169812000000001e-10 3.0867968e-10 4.4712729e-10 ] [ 4.7044267e-10 4.4912892e-10 2.6038417e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.2e-06 -1.11e-05 1.36e-05 ] [ 1.86e-05 -1.53e-05 1.1e-06 ] [ 2.5e-06 9.3e-06 2.2e-06 ] [ -1.62e-05 -1.9e-06 -1.12e-05 ] [ 3e-07 6.1e-06 -8.1e-06 ] [ -2.8e-06 1.44e-05 -9e-06 ] [ 6.9e-06 -1.4e-06 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.474002491136e-14 -1.778416049088e-14 2.178960204288e-14 ] [ 2.980048514688e-14 -2.451330229824e-14 1.76239428288e-15 ] [ 4.005441552e-15 1.490024257344e-14 3.52478856576e-15 ] [ -2.595526125696e-14 -3.04413557952e-15 -1.794437815296e-14 ] [ 4.8065298624e-16 9.77327738688e-15 -1.297763062848e-14 ] [ -4.48609453824e-15 2.307134333952e-14 -1.44195895872e-14 ] [ 1.105501868352e-14 -2.24304726912e-15 1.84250311392e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }