{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5907749 1.9376322 -3.576925 ] [ 2.0956791 -2.783016 -0.9321888 ] [ 3.1025812 2.3819019 2.0815083 ] [ -4.4082231 0.3097286 3.2061291 ] [ -2.9346695 -4.7423886 -5.8951378 ] [ 1.652016 9.3198753 -1.616746 ] [ -0.0981587 -6.4237335 6.7333603 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.465257407336865e-10 3.104429036126014e-09 -5.73086565657045e-09 ] [ 3.357648086382149e-09 -4.458883207248144e-09 -1.493531113836499e-09 ] [ 4.970883103727681e-09 3.816227568660204e-09 3.334943961737061e-09 ] [ -7.062752048279045e-09 4.962399258015323e-10 5.136785129607449e-09 ] [ -4.701858901412462e-09 -7.598144204267972e-09 -9.445052037370165e-09 ] [ 2.646821434194144e-09 1.493208643745374e-08 -2.590312664312964e-09 ] [ -1.572675755638158e-10 -1.029195571674304e-08 1.078803254096323e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.880882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.025050796971119e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8538888 2.9500846 2.0385225 ] [ 2.9273584 1.4060391 2.0957078 ] [ 2.070694 2.4536171 4.2175263 ] [ 1.6723391 4.8253295 3.4520974 ] [ 3.1582601 3.881377 1.5889854 ] [ 3.7283746 6.143453 2.6879332 ] [ 4.0242459 3.9384897 3.9625693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.538888e-11 2.9500846e-10 2.0385225e-10 ] [ 2.9273584e-10 1.4060391e-10 2.0957078e-10 ] [ 2.070694e-10 2.4536171e-10 4.2175263e-10 ] [ 1.6723391e-10 4.8253295e-10 3.4520974e-10 ] [ 3.1582601e-10 3.881377e-10 1.5889854e-10 ] [ 3.7283746e-10 6.143453e-10 2.6879332e-10 ] [ 4.024245900000001e-10 3.9384897e-10 3.9625693e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.87e-05 -9.6e-06 -6e-06 ] [ 1.85e-05 6.93e-05 1.46e-05 ] [ -6.82e-05 -5.86e-05 5.15e-05 ] [ -9.8e-06 2.64e-05 3.47e-05 ] [ 2.9e-06 -2.6e-05 -0.0001008 ] [ 1e-06 5e-07 -3.3e-06 ] [ 3.69e-05 -2.1e-06 9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.99607030558e-14 -1.53808956864e-14 -9.613059803999999e-15 ] [ 2.9640267729e-14 1.110308407362e-13 2.33917788564e-14 ] [ -1.092684464388e-13 -9.38875507524e-14 8.251209665099998e-14 ] [ -1.57013310132e-14 4.22974631376e-14 5.55955291998e-14 ] [ 4.6463122386e-15 -4.165659248399999e-14 -1.614994047072e-13 ] [ 1.602176634e-15 8.010883169999999e-16 -5.2871828922e-15 ] [ 5.91203177946e-14 -3.364570931399999e-15 1.49002426962e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.711622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.959238335664034e-18 } }