{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5234552 1.0960053 1.6466861 ] [ 0.1571181 -0.3251986 1.3661625 ] [ -0.7168285 -0.2293547 -2.2747289 ] [ -0.9637449 -0.5414521 -0.7381197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.440844324385796e-09 1.75599408240016e-09 2.638281992952587e-09 ] [ 2.517309485984754e-10 -5.210255983295123e-10 2.188833635747025e-09 ] [ -1.148485873285269e-09 -3.674667412380797e-10 -3.644517492264522e-09 ] [ -1.544089559916667e-09 -8.675019030502312e-10 -1.18259813643509e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4203782 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.509310983548298e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4677177 2.4675675 1.2235664 ] [ 1.6904431 4.6491755 0.7413653 ] [ 2.5925154 4.2920772 2.8988715 ] [ 4.2257698 2.5835087 2.8021404 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4677177e-10 2.4675675e-10 1.2235664e-10 ] [ 1.6904431e-10 4.6491755e-10 7.413653e-11 ] [ 2.5925154e-10 4.2920772e-10 2.8988715e-10 ] [ 4.2257698e-10 2.5835087e-10 2.8021404e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 5.6e-06 1.14e-05 ] [ 1.33e-05 -1.3e-06 -4e-07 ] [ -1.33e-05 -7.5e-06 -2.7e-06 ] [ 8.9e-06 3.3e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.42593720426e-14 8.972189150399999e-15 1.82648136276e-14 ] [ 2.13089492322e-14 -2.0828296242e-15 -6.408706536e-16 ] [ -2.13089492322e-14 -1.2016324755e-14 -4.3258769118e-15 ] [ 1.42593720426e-14 5.2871828922e-15 -1.32980660622e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }