{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8661829 6.4308824 0.6664757 ] [ 1.5104145 -0.4081377 -0.8197435 ] [ -1.009555 -5.0326376 1.5662781 ] [ 0.0382594 -0.906186 -0.4906703 ] [ 2.3462912 0.6782843 -6.9967118 ] [ 5.9240296 1.9547735 0.7154202 ] [ -1.9432568 -2.7169789 5.3589515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.100083780715036e-08 1.030340951728184e-08 1.067811793668794e-09 ] [ 2.419950819554793e-09 -6.539086863945016e-10 -1.313373881573379e-09 ] [ -1.61748543173787e-09 -8.063174370109839e-09 2.509454174165915e-09 ] [ 6.129831671085959e-11 -1.451870035257924e-09 -7.861404896577702e-10 ] [ 3.759172937199821e-09 1.086731256669046e-09 -1.120996816079208e-08 ] [ 9.491341804244365e-09 3.131892426462399e-09 1.146229527931607e-09 ] [ -3.113440638821611e-09 -4.353080108651022e-09 8.58598687603925e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.775892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.046923564090753e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5254364 5.7498421 2.6933903 ] [ 5.881034 3.3263691 0.7386543 ] [ 3.3086501 2.5328832 2.9142285 ] [ 5.7491686 2.783718 3.0603326 ] [ 3.6169674 4.0398761 0.9973835 ] [ 5.1829269 4.7733521 4.2970729 ] [ 2.7443567 4.2532694 4.545093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5254364e-10 5.749842100000001e-10 2.6933903e-10 ] [ 5.881034e-10 3.3263691e-10 7.386543e-11 ] [ 3.3086501e-10 2.5328832e-10 2.9142285e-10 ] [ 5.7491686e-10 2.783718e-10 3.0603326e-10 ] [ 3.6169674e-10 4.0398761e-10 9.973835e-11 ] [ 5.182926900000001e-10 4.773352100000001e-10 4.2970729e-10 ] [ 2.7443567e-10 4.2532694e-10 4.545093e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 5.13e-05 -1.4e-06 ] [ 5.25e-05 3.3e-06 -1.43e-05 ] [ -3.36e-05 -7.1e-05 2.54e-05 ] [ -3.24e-05 -1.31e-05 -2.23e-05 ] [ 9.6e-06 1.09e-05 5.11e-05 ] [ -4.25e-05 7e-07 -1.8e-06 ] [ 8e-05 1.78e-05 -3.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313490239999e-14 8.21916613242e-14 -2.2430472876e-15 ] [ 8.4114273285e-14 5.2871828922e-15 -2.29111258662e-14 ] [ -5.383313490239999e-14 -1.13754541014e-13 4.06952865036e-14 ] [ -5.19105229416e-14 -2.09885139054e-14 -3.572853893819999e-14 ] [ 1.53808956864e-14 1.74637253106e-14 8.187122599739999e-14 ] [ -6.8092506945e-14 1.1215236438e-15 -2.8839179412e-15 ] [ 1.2817413072e-13 2.851874408519999e-14 -5.896010013119999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.063306 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.894060680599201e-18 } }