{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.5281148 -3.3927606 -8.203725 ] [ -6.4318035 -5.9192665 6.8584166 ] [ -9.7545747 4.8686376 -5.3646022 ] [ 5.606829 11.7800172 2.2945071 ] [ 7.0514343 -7.3366277 4.4154035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.652663094629582e-09 -5.43580175807582e-09 -1.314381650676165e-08 ] [ -1.030488528217942e-08 -9.48371047671896e-09 1.098839482275772e-08 ] [ -1.562855165894756e-08 7.800417402133838e-09 -8.595040295544994e-09 ] [ 8.983130414633585e-09 1.88736683059581e-08 3.676205662167101e-09 ] [ 1.129764327164615e-08 -1.175457347329716e-08 7.074256317381818e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7676838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.63867158266033e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2730295 1.8059395 1.4499727 ] [ 0.2849705 1.0964009 3.0080985 ] [ 0.5420379 3.5631462 2.0699871 ] [ 3.0127181 4.0303457 2.4364782 ] [ 3.8604819 1.7726127 3.5386744 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2730295e-10 1.8059395e-10 1.4499727e-10 ] [ 2.849705e-11 1.0964009e-10 3.0080985e-10 ] [ 5.420379e-11 3.5631462e-10 2.0699871e-10 ] [ 3.0127181e-10 4.0303457e-10 2.4364782e-10 ] [ 3.8604819e-10 1.7726127e-10 3.5386744e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.59e-05 2.41e-05 2.59e-05 ] [ 2.96e-05 2.74e-05 6.8e-06 ] [ 2.11e-05 -3.39e-05 -2.55e-05 ] [ -1.28e-05 -1.43e-05 2.22e-05 ] [ -2.2e-05 -3.3e-06 -2.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.54746084806e-14 3.86124568794e-14 4.149637482059999e-14 ] [ 4.74244283664e-14 4.389963977159999e-14 1.08948011112e-14 ] [ 3.38059269774e-14 -5.431378789259999e-14 -4.0855504167e-14 ] [ -2.05078609152e-14 -2.29111258662e-14 3.55683212748e-14 ] [ -3.5247885948e-14 -5.2871828922e-15 -4.69437753762e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260879992939e-18 } }