{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.661132 -1.2974585 1.9771446 ] [ -0.8863827 3.3207199 0.8574734 ] [ -4.9588934 -0.0533118 -4.5873247 ] [ -0.8158559 -1.9699495 1.7527067 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.067230995846275e-08 -2.078757675158237e-09 3.167734854060968e-09 ] [ -1.42014163902158e-09 5.320379788005314e-09 1.373823834437887e-09 ] [ -7.945023070519422e-09 -8.541491957276544e-11 -7.349704386358374e-09 ] [ -1.307145248921743e-09 -3.15620703305665e-09 2.80814569785952e-09 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1070459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.182389542332495e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8327116 0.5713692 -0.9700414 ] [ 2.8087821 2.6562253 2.0711234 ] [ 1.8606147 1.0497272 0.9027818 ] [ 1.3258435 4.2275585 2.5414578 ] [ 4.9510141 2.7367128 2.5669861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.327116e-11 5.713692e-11 -9.700414000000001e-11 ] [ 2.8087821e-10 2.6562253e-10 2.0711234e-10 ] [ 1.8606147e-10 1.0497272e-10 9.027818e-11 ] [ 1.3258435e-10 4.2275585e-10 2.5414578e-10 ] [ 4.951014100000001e-10 2.7367128e-10 2.5669861e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1257931 -0.1648772 -0.1781619 ] [ -0.8159099 0.9505925 0.3806451 ] [ -0.0960916 -0.4115581 -0.3023879 ] [ 0.5648162 -0.3938329 -0.0392302 ] [ 0.4729784 0.0196757 0.1391349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.015427638779565e-10 -2.641623951429658e-10 -2.854468308973076e-10 ] [ -1.307231766459266e-09 1.523017079407824e-09 6.098606800420782e-10 ] [ -1.539557149752653e-10 -6.593887659208686e-10 -4.844788237928083e-10 ] [ 9.049353106890969e-10 -6.309898648818643e-10 -6.285370926930816e-11 ] [ 7.577949346233908e-10 3.152394653787456e-11 2.229186839173459e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.19316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.633124264407373e-18 } }