{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.0208642 3.2810265 -7.2141782 ] [ -4.9350489 9.1643287 0.6038378 ] [ -7.3815797 -5.6245568 4.0241665 ] [ -6.8026598 -8.3557792 5.692121 ] [ -0.8742726 -0.3796062 0.6525146 ] [ 8.8801885 3.9554483 2.5299687 ] [ 1.0925083 -2.0408612 -6.2884303 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.60551943414517e-08 5.256783950525252e-09 -1.155838765032503e-08 ] [ -7.906819970084757e-09 1.468287318846646e-08 9.674548059153062e-10 ] [ -1.182659441991188e-08 -9.01153340732166e-09 6.447425484506563e-09 ] [ -1.0899062490816e-08 -1.338743408280693e-08 9.119783188964718e-09 ] [ -1.40073911992603e-09 -6.08196178750729e-10 1.045443636850664e-09 ] [ 1.422763040299702e-08 6.337326791043105e-09 4.053456702495768e-09 ] [ 1.750391256289952e-09 -3.269820100937833e-09 -1.007517600819033e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -19.543736 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.131251690228731e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8904534 1.7779499 3.4373702 ] [ 2.9272252 6.036229 2.3486737 ] [ 2.6097055 3.5857656 1.7164281 ] [ 4.5836149 2.0390572 1.5748344 ] [ 5.2132653 2.6411068 3.9507748 ] [ 4.9145523 4.4422459 2.2258601 ] [ 3.2344864 4.1831364 4.0740317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8904534e-10 1.7779499e-10 3.4373702e-10 ] [ 2.9272252e-10 6.036229e-10 2.3486737e-10 ] [ 2.6097055e-10 3.5857656e-10 1.7164281e-10 ] [ 4.5836149e-10 2.0390572e-10 1.5748344e-10 ] [ 5.213265299999999e-10 2.6411068e-10 3.9507748e-10 ] [ 4.9145523e-10 4.4422459e-10 2.2258601e-10 ] [ 3.2344864e-10 4.183136400000001e-10 4.0740317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.54e-05 -5.04e-05 3.59e-05 ] [ 7.73e-05 -9.23e-05 -0.000126 ] [ -3.98e-05 2.57e-05 7.91e-05 ] [ 8.1e-06 6.41e-05 -0.0001308 ] [ 4.78e-05 -2.31e-05 3.45e-05 ] [ -4.06e-05 4.77e-05 9.71e-05 ] [ -1.74e-05 2.84e-05 1.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.671705237632e-14 -8.074970168832e-14 5.751814068672e-14 ] [ 1.2384825278784e-13 -1.4788090209984e-13 -2.018742542208e-13 ] [ -6.376662950784e-14 4.117593915456e-14 1.2673217070528e-13 ] [ 1.297763062848e-14 1.0269952139328e-13 -2.0956470200064e-13 ] [ 7.658404247424001e-14 -3.701027994048e-14 5.52750934176e-14 ] [ -6.504837080448e-14 7.642382481215999e-14 1.5557134987968e-13 ] [ -2.787787320192e-14 4.550181603071999e-14 1.650241919424e-14 ] ] } "relaxed-potential-energy" { "source-value" -27.526802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.410279860979068e-18 } }