{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3959895 0.013616 -2.3938086 ] [ 0.137592 -0.2318307 2.2128932 ] [ -1.44956 0.9561299 -1.3666109 ] [ -0.1777869 -0.169976 -0.516723 ] [ 0.4261146 0.0960784 -0.1432088 ] [ 0.3233529 0.1586405 1.149392 ] [ 1.136277 -0.8226581 1.0580661 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.344451189822815e-10 2.18152368688128e-11 -3.835304173589979e-09 ] [ 2.204466856091136e-10 -3.714337275236986e-10 3.545445749367299e-09 ] [ -2.322451142446848e-09 1.531888972227842e-09 -2.189552033710447e-09 ] [ -2.848460146645075e-10 -2.723315732971008e-10 -8.278815100296384e-10 ] [ 6.827108499015437e-10 1.539345662438707e-10 -2.29445791252823e-10 ] [ 5.180684566478804e-10 2.541701002120224e-10 1.841528990534553e-09 ] [ 1.820516444152762e-09 -1.318043574731748e-09 1.695208768681035e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.181801158928927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.150651391207027e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3259585 1.8004006 1.5600819 ] [ 2.0303508 1.7034362 3.813847 ] [ 2.5901139 3.7174067 2.2545762 ] [ 3.4898692 0.8054767 1.8481056 ] [ 4.8331441 2.7868824 2.2564435 ] [ 4.4134263 1.1268924 4.0399913 ] [ 3.7032223 3.4253213 4.3608264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3259585e-10 1.8004006e-10 1.5600819e-10 ] [ 2.0303508e-10 1.7034362e-10 3.813847e-10 ] [ 2.5901139e-10 3.7174067e-10 2.2545762e-10 ] [ 3.4898692e-10 8.054767000000001e-11 1.8481056e-10 ] [ 4.833144100000001e-10 2.7868824e-10 2.2564435e-10 ] [ 4.4134263e-10 1.1268924e-10 4.0399913e-10 ] [ 3.7032223e-10 3.4253213e-10 4.3608264e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.28e-05 -2.31e-05 1.13e-05 ] [ -8.2e-06 -1.07e-05 4.8e-06 ] [ 4.4e-06 6e-07 -2.21e-05 ] [ 5e-06 3.01e-05 -9.3e-06 ] [ 1.49e-05 -2.13e-05 1.49e-05 ] [ -1.55e-05 1.04e-05 -2.32e-05 ] [ 1.21e-05 1.4e-05 2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.050786074624e-14 -3.701027994048e-14 1.810459581504e-14 ] [ -1.313784829056e-14 -1.714328984256e-14 7.69044777984e-15 ] [ 7.04957713152e-15 9.6130597248e-16 -3.540810331968e-14 ] [ 8.010883104e-15 4.822551628608e-14 -1.490024257344e-14 ] [ 2.387243164992e-14 -3.412636202304e-14 2.387243164992e-14 ] [ -2.48337376224e-14 1.666263685632e-14 -3.717049760256e-14 ] [ 1.938633711168e-14 2.24304726912e-14 3.781136825088e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }