{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3993617 -1.5010771 -2.4814837 ] [ -1.9225369 -1.1462016 0.4953619 ] [ 1.3737242 1.1841068 0.5055582 ] [ -1.8863566 1.5492149 1.2258504 ] [ -0.8162564 0.5856804 -0.1623391 ] [ 1.5630875 -0.995299 -0.0184324 ] [ 0.2889765 0.3235757 0.4354848 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.242024599782944e-09 -2.404990635638264e-09 -3.975775169036281e-09 ] [ -3.080243673805308e-09 -1.836417406243553e-09 7.936572550150675e-10 ] [ 2.200948796667184e-09 1.897148231490302e-09 8.099935284937305e-10 ] [ -3.022276443011777e-09 2.48211589337501e-09 1.964028851478328e-09 ] [ -1.307786920658373e-09 9.383634441407924e-10 -2.600959106617133e-10 ] [ 2.50434224876472e-09 -1.594644788505619e-09 -2.953196034523392e-11 ] [ 4.629913922606113e-10 5.184254215989946e-10 6.977235652737638e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.492079 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.122975326458665e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3747098 0.9756811 2.065325 ] [ 0.8452802 1.3384893 3.8214219 ] [ 2.341808 2.5521698 5.1763755 ] [ 2.0238451 3.2297881 2.9101532 ] [ 4.3877875 0.1864655 3.0030436 ] [ 4.2308048 2.5120844 2.4003096 ] [ 4.5232496 1.8427645 4.6724271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3747098e-10 9.756811e-11 2.065325e-10 ] [ 8.452802000000001e-11 1.3384893e-10 3.8214219e-10 ] [ 2.341808e-10 2.5521698e-10 5.1763755e-10 ] [ 2.0238451e-10 3.2297881e-10 2.9101532e-10 ] [ 4.3877875e-10 1.864655e-11 3.0030436e-10 ] [ 4.2308048e-10 2.5120844e-10 2.4003096e-10 ] [ 4.5232496e-10 1.8427645e-10 4.6724271e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 4.9e-06 1.2e-06 ] [ -1e-06 -1.1e-06 -2.8e-06 ] [ -3.5e-06 3.9e-06 5.9e-06 ] [ 9.1e-06 -7e-06 -2.6e-06 ] [ 1.1e-06 -1.6e-06 -3e-07 ] [ -9.2e-06 1.7e-06 -0.0 ] [ 3.2e-06 -7e-07 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 7.850665441919999e-15 1.92261194496e-15 ] [ -1.6021766208e-15 -1.76239428288e-15 -4.48609453824e-15 ] [ -5.6076181728e-15 6.24848882112e-15 9.45284206272e-15 ] [ 1.457980724928e-14 -1.12152363456e-14 -4.16565921408e-15 ] [ 1.76239428288e-15 -2.56348259328e-15 -4.8065298624e-16 ] [ -1.474002491136e-14 2.72370025536e-15 0.0 ] [ 5.126965186560001e-15 -1.12152363456e-15 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.037892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.370641871331535e-18 } }