{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -30.6521988 -9.7738075 27.2230894 ] [ -2.2854719 1.3879032 2.0386747 ] [ 20.9819572 -7.6822123 -32.4108949 ] [ 7.3233629 -4.1640943 5.4715764 ] [ 4.6323506 20.2322108 -2.3224455 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.911023669808284e-08 -1.565936600171395e-08 4.361619774197307e-08 ] [ -3.661729675843585e-09 2.223666077293829e-09 3.266316968666959e-09 ] [ 3.361680156142806e-08 -1.23082610444874e-08 -5.192797849580976e-08 ] [ 1.173332092068248e-08 -6.671614589232586e-09 8.766431859225837e-09 ] [ 7.421843891815879e-09 3.241557539792244e-08 -3.720967913838447e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.1312738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.221206985016388e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6662405 0.14848 2.2380373 ] [ -0.024612 2.418349 2.4196572 ] [ 2.2710479 0.8661064 0.4405561 ] [ 3.0133508 -0.7028538 2.2352774 ] [ 1.4817112 3.0919255 0.7324995 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.662405000000001e-11 1.4848e-11 2.2380373e-10 ] [ -2.4612e-12 2.418349e-10 2.4196572e-10 ] [ 2.2710479e-10 8.661064e-11 4.405561e-11 ] [ 3.0133508e-10 -7.028538e-11 2.2352774e-10 ] [ 1.4817112e-10 3.0919255e-10 7.324995e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.00012 -6.54e-05 0.0001069 ] [ -8.6e-06 -2.11e-05 2.31e-05 ] [ 6.03e-05 7.45e-05 -0.000106 ] [ 4.19e-05 -5.09e-05 3.64e-05 ] [ 2.65e-05 6.29e-05 -6.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9226119608e-13 -1.047823518636e-13 1.712726821746e-13 ] [ -1.37787190524e-14 -3.38059269774e-14 3.70102802454e-14 ] [ 9.661125103019999e-14 1.19362159233e-13 -1.69830723204e-13 ] [ 6.713120096459999e-14 -8.155079067059998e-14 5.831922947759999e-14 ] [ 4.2457680801e-14 1.007769102786e-13 -9.677146869359998e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.146626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785886372513688e-18 } }