{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5044789 -3.2961738 -3.6724995 ] [ 0.1780802 -1.1934053 -0.6789959 ] [ -3.3622435 -1.1723288 6.4742621 ] [ 0.4394937 0.3285618 0.8994541 ] [ 2.7923412 -2.2950207 -0.4143801 ] [ 2.5951038 2.4498796 -2.7715161 ] [ 3.8617034 5.1784872 0.1636754 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.042132410992602e-08 -5.281052643962989e-09 -5.883992887276683e-09 ] [ 2.853159354180468e-10 -1.91204608655176e-09 -1.0878713655618e-09 ] [ -5.386907973518378e-09 -1.878277810725259e-09 1.037291145901177e-08 ] [ 7.041465369302057e-10 5.264140387849811e-10 1.441084342375499e-09 ] [ 4.473823824795521e-09 -3.677028540086323e-09 -6.639101138145832e-10 ] [ 4.157814671164608e-09 3.925139851233266e-09 -4.440458336174807e-09 ] [ 6.187130954918355e-09 8.296851191308084e-09 2.622369014406035e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.937328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.752353135999395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4853646 3.2555309 1.6083631 ] [ 2.609172 0.6664754 2.8047803 ] [ 2.3851418 2.7355207 4.0266465 ] [ 4.6600171 1.2761078 1.7485544 ] [ 5.4102834 2.097032 3.9989145 ] [ 3.9460885 3.5346 1.070444 ] [ 4.3047264 4.273745 3.377456 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4853646e-10 3.2555309e-10 1.6083631e-10 ] [ 2.609172e-10 6.664754000000001e-11 2.8047803e-10 ] [ 2.3851418e-10 2.7355207e-10 4.0266465e-10 ] [ 4.6600171e-10 1.2761078e-10 1.7485544e-10 ] [ 5.4102834e-10 2.097032e-10 3.998914500000001e-10 ] [ 3.9460885e-10 3.5346e-10 1.070444e-10 ] [ 4.3047264e-10 4.273745e-10 3.377456e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.25e-05 2.83e-05 1.5e-05 ] [ 8.2e-06 -5.8e-06 2.1e-05 ] [ 4e-05 -8.02e-05 -2.2e-05 ] [ -4.76e-05 -1.19e-05 1.46e-05 ] [ -2.38e-05 -2.64e-05 -3.1e-06 ] [ 2.45e-05 -4.3e-06 -1.15e-05 ] [ -3.38e-05 0.0001004 -1.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.207074060499999e-14 4.53415987422e-14 2.403264951e-14 ] [ 1.31378483988e-14 -9.2926244772e-15 3.364570931399999e-14 ] [ 6.408706535999999e-14 -1.284945660468e-13 -3.5247885948e-14 ] [ -7.62636077784e-14 -1.90659019446e-14 2.33917788564e-14 ] [ -3.81318038892e-14 -4.22974631376e-14 -4.9667475654e-15 ] [ 3.925332753299999e-14 -6.8893595262e-15 -1.8425031291e-14 ] [ -5.415357022919999e-14 1.608585340536e-13 -2.25906905394e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.508478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.965385098250305e-18 } }