{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4751526 -2.4674416 -0.103281 ] [ 0.1358988 0.8334444 0.1760617 ] [ 0.0253599 2.0245116 -0.1531198 ] [ 1.0355756 -5.0345088 1.3569315 ] [ -1.6719869 4.6439944 -1.2765924 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.61278387032334e-10 -3.953277244709345e-09 -1.654744035728448e-10 ] [ 2.17733880154775e-10 1.335325132416683e-09 2.820819395583034e-10 ] [ 4.063103888582592e-11 3.243625154058401e-09 -2.453249637415719e-10 ] [ 1.659175015390933e-09 -8.066172296571864e-09 2.174043925327075e-09 ] [ -2.678818321463868e-09 7.440499254806124e-09 -2.045326497570962e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.083713399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.542830134301932e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3342911 0.0608663 2.3353836 ] [ 0.0551622 1.7394754 0.6889258 ] [ 0.0229139 2.3367247 2.9098251 ] [ 2.6512721 0.4567072 2.2624966 ] [ 2.0146768 2.6406012 1.6660429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.342911e-11 6.08663e-12 2.3353836e-10 ] [ 5.516220000000001e-12 1.7394754e-10 6.889258000000001e-11 ] [ 2.29139e-12 2.3367247e-10 2.9098251e-10 ] [ 2.6512721e-10 4.567072e-11 2.2624966e-10 ] [ 2.0146768e-10 2.6406012e-10 1.6660429e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 -1.54e-05 -7.8e-06 ] [ 1.19e-05 1.66e-05 1.55e-05 ] [ 1.06e-05 -2.29e-05 6.3e-06 ] [ -2.49e-05 2.23e-05 2.1e-05 ] [ 7.3e-06 -6e-07 -3.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 -2.467351996032e-14 -1.249697764224e-14 ] [ 1.906590178752e-14 2.659613190528e-14 2.48337376224e-14 ] [ 1.698307218048e-14 -3.668984461632e-14 1.009371271104e-14 ] [ -3.989419785791999e-14 3.572853864384e-14 3.36457090368e-14 ] [ 1.169588933184e-14 -9.6130597248e-16 -5.623639939008e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }