{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.599025 3.051266 5.123232 ] [ 1.56583 2.880417 3.388537 ] [ 2.27514 4.963397 2.856014 ] [ 3.509207 1.897473 3.301843 ] [ 3.336514 3.219201 1.422465 ] [ 4.208969 3.943636 3.692529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.599025e-10 3.051266e-10 5.123232e-10 ] [ 1.56583e-10 2.880417e-10 3.388537e-10 ] [ 2.27514e-10 4.963397e-10 2.856014e-10 ] [ 3.509207e-10 1.897473e-10 3.301843e-10 ] [ 3.336514e-10 3.219201e-10 1.422465e-10 ] [ 4.208969e-10 3.943636e-10 3.692529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2889673 0.0683875 7.0619035 ] [ -9.2938182 -0.8715396 -4.6719605 ] [ 0.0736179 2.3769255 -1.7225424 ] [ 3.3719107 -6.4805335 -0.5112088 ] [ -0.0675439 1.224683 -0.2364229 ] [ 3.6268661 3.6820771 0.080231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.6673298938357e-09 1.0956885365496e-10 1.131441668604569e-08 ] [ -1.489033823800554e-08 -1.396360371221384e-09 -7.485305886401078e-09 ] [ 1.179488782523923e-10 3.80825446548335e-09 -2.759817161616722e-09 ] [ 5.402396490965363e-09 -1.03829592640112e-08 -8.19046787707223e-10 ] [ -1.082172574576531e-10 1.962158470491207e-09 -3.787912430017363e-10 ] [ 5.810880072192075e-09 5.899337845603063e-09 1.285442324634048e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.069024279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.519295569412654e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6197581 3.3475624 4.9871835 ] [ 1.3501398 2.6767523 3.031474 ] [ 2.2797815 4.9138184 3.1656583 ] [ 3.5517739 1.7379757 3.4292162 ] [ 3.2118082 3.30424 1.6076906 ] [ 4.4814235 3.9750411 3.5633974 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6197581e-10 3.3475624e-10 4.987183500000001e-10 ] [ 1.3501398e-10 2.6767523e-10 3.031474e-10 ] [ 2.2797815e-10 4.9138184e-10 3.1656583e-10 ] [ 3.5517739e-10 1.7379757e-10 3.4292162e-10 ] [ 3.2118082e-10 3.30424e-10 1.6076906e-10 ] [ 4.4814235e-10 3.9750411e-10 3.5633974e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 -1.8e-06 2.12e-05 ] [ 2.84e-05 1.83e-05 9.2e-06 ] [ 1.25e-05 8e-07 8.3e-06 ] [ 1.11e-05 1.07e-05 -1.27e-05 ] [ -9e-07 -2.13e-05 -2.47e-05 ] [ -3.46e-05 -6.8e-06 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.64359142432e-14 -2.88391791744e-15 3.396614436096001e-14 ] [ 4.550181603071999e-14 2.931983216064e-14 1.474002491136e-14 ] [ 2.002720776e-14 1.28174129664e-15 1.329806595264e-14 ] [ 1.778416049088e-14 1.714328984256e-14 -2.034764308416e-14 ] [ -1.44195895872e-15 -3.412636202304e-14 -3.957376253376001e-14 ] [ -5.543531107968001e-14 -1.089480102144e-14 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }