{ "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" [ [ -0.4346798 -0.0278969 -0.8078366 ] [ 0.1299406 -1.1543867 2.1088575 ] [ 1.726988 1.0551831 -2.4428759 ] [ -0.4742488 -0.2428244 1.6030687 ] [ -1.1005436 -2.426915 -3.8020516 ] [ 1.1584774 3.2803774 1.0258822 ] [ -1.0059338 -0.4835375 2.3149556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.964338130940198e-10 -4.469576097279552e-11 -1.294296913946561e-09 ] [ 2.081877914127245e-10 -1.849531382102464e-09 3.378762183098736e-09 ] [ 2.766939798002151e-09 1.690589693483268e-09 -3.913918654495759e-09 ] [ -7.59830339802455e-10 -3.890475766397876e-10 2.568399192676249e-09 ] [ -1.763265226091067e-09 -3.888346473668832e-09 -6.091558184595233e-09 ] [ 1.85608540600517e-09 5.25574397768069e-09 1.64364447653487e-09 ] [ -1.611683616432503e-09 -7.7471247778008e-10 3.708967740510036e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.084189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.339365440912853e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7605772 2.7546947 2.2585581 ] [ 2.8624867 1.7816778 2.1892186 ] [ 2.0310938 2.5488941 4.2108569 ] [ 1.7344311 4.7073389 3.2119584 ] [ 3.3490621 3.9868203 1.543817 ] [ 3.7279468 5.9579832 2.7911907 ] [ 3.9695631 3.860981 3.8377423 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.605772e-11 2.7546947e-10 2.2585581e-10 ] [ 2.8624867e-10 1.7816778e-10 2.1892186e-10 ] [ 2.0310938e-10 2.5488941e-10 4.2108569e-10 ] [ 1.7344311e-10 4.7073389e-10 3.2119584e-10 ] [ 3.3490621e-10 3.986820300000001e-10 1.543817e-10 ] [ 3.7279468e-10 5.9579832e-10 2.7911907e-10 ] [ 3.9695631e-10 3.860981000000001e-10 3.8377423e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.39e-05 4.39e-05 3.58e-05 ] [ 4.7e-06 -0.0001309 -1.34e-05 ] [ -6.24e-05 2.5e-06 7.2e-06 ] [ -1.05e-05 -3.54e-05 1.76e-05 ] [ 2.47e-05 7.13e-05 -2.88e-05 ] [ -2.4e-06 4.22e-05 -1.35e-05 ] [ 1.2e-05 6.5e-06 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.431378744512e-14 7.033555365312e-14 5.735792302464001e-14 ] [ 7.53023011776e-15 -2.0972491966272e-13 -2.146916671872e-14 ] [ -9.997582113791999e-14 4.005441552e-15 1.153567166976e-14 ] [ -1.68228545184e-14 -5.671705237632e-14 2.819830852608e-14 ] [ 3.957376253376001e-14 1.1423519306304e-13 -4.614268667904e-14 ] [ -3.84522388992e-15 6.761185339776e-14 -2.16293843808e-14 ] [ 1.92261194496e-14 1.04141480352e-14 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -29.201715 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.678630506026468e-18 } }