{ "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" [ [ 0.1446516 0.7602583 1.64121 ] [ 0.5863284 2.091282 0.4918312 ] [ 1.988461 0.5220119 2.855455 ] [ 2.293973 2.837851 0.0455476 ] [ 2.215952 2.17866 2.777134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.446516e-11 7.602583e-11 1.64121e-10 ] [ 5.863284e-11 2.091282e-10 4.918312e-11 ] [ 1.988461e-10 5.220119e-11 2.855455e-10 ] [ 2.293973e-10 2.837851e-10 4.55476e-12 ] [ 2.215952e-10 2.17866e-10 2.777134e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2389395 -5.5665765 2.8101022 ] [ -3.4689643 3.27859 -3.8378478 ] [ -0.5008647 -9.5997375 0.8695351 ] [ 4.1314253 1.0169711 0.594449 ] [ 3.0773432 10.8707529 -0.4362385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.189353185839643e-09 -8.9186387996735e-09 4.502280083991995e-09 ] [ -5.557893545640166e-09 5.252880290466059e-09 -6.148910070008305e-09 ] [ -8.024737191354198e-10 -1.538047511503357e-08 1.393148819662853e-09 ] [ 6.61927308077644e-09 1.629367333873277e-09 9.524122979046658e-10 ] [ 4.930447369838788e-09 1.741686629036774e-08 -6.989311315512089e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.812334232689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.312386096613711e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0229637 0.5905063 1.8570335 ] [ 0.3288849 2.2478405 0.2500525 ] [ 2.0971773 0.2392074 2.8005307 ] [ 2.5684335 2.7907137 0.3255517 ] [ 2.2119066 2.5217953 2.5780094 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.29637e-12 5.905063000000001e-11 1.8570335e-10 ] [ 3.288849e-11 2.2478405e-10 2.500525e-11 ] [ 2.0971773e-10 2.392074e-11 2.8005307e-10 ] [ 2.5684335e-10 2.7907137e-10 3.255517e-11 ] [ 2.2119066e-10 2.5217953e-10 2.5780094e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 5.6e-06 2.62e-05 ] [ 2.24e-05 -3.2e-06 1.3e-05 ] [ 3e-07 3e-06 -4.7e-06 ] [ 1.29e-05 2.04e-05 5.2e-06 ] [ -3.35e-05 -2.59e-05 -3.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.364570931399999e-15 8.972189150399999e-15 4.197702781079999e-14 ] [ 3.588875660159999e-14 -5.1269652288e-15 2.082829624199999e-14 ] [ 4.806529901999999e-16 4.806529901999999e-15 -7.530230179799999e-15 ] [ 2.06680785786e-14 3.26844033336e-14 8.331318496799998e-15 ] [ -5.367291723899999e-14 -4.149637482059999e-14 -6.34461947064e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.601878432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.858825853536394e-18 } }