{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.8435991 -5.7825011 6.9469379 ] [ 0.5136742 -0.4552241 0.0500875 ] [ -25.4695169 -1.7009296 4.8883476 ] [ 17.5656011 3.2001186 -12.0691694 ] [ 9.4055607 -10.3912984 6.1296337 ] [ 19.8282801 15.1298347 -5.9458373 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.499730379214793e-08 -9.264588072170284e-09 1.113022148952945e-08 ] [ 8.229967939481433e-10 -7.293494102447213e-10 8.024902149432001e-11 ] [ -4.080666452025049e-08 -2.725189638746695e-09 7.83199623906379e-09 ] [ 2.814319541271876e-08 5.127155204707228e-09 -1.933694104515476e-08 ] [ 1.506936945905529e-08 -1.664869535623645e-08 9.820755808207801e-09 ] [ 3.176840680689389e-08 2.424066743290858e-08 -9.526281513140595e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3490204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.967898808262264e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0180105 -1.015449 1.6760581 ] [ 0.9339547 2.0010405 -0.5783343 ] [ 0.7127293 3.942953 3.027354 ] [ 1.445989 0.435034 0.8834072 ] [ 3.2441113 0.9991064 2.0392413 ] [ 2.6222464 2.855533 3.0660338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.80105e-12 -1.015449e-10 1.6760581e-10 ] [ 9.339547e-11 2.0010405e-10 -5.783343e-11 ] [ 7.127293e-11 3.942953e-10 3.027354e-10 ] [ 1.445989e-10 4.35034e-11 8.834072e-11 ] [ 3.2441113e-10 9.991064e-11 2.0392413e-10 ] [ 2.6222464e-10 2.855533e-10 3.0660338e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.3664898 0.2203572 -0.2824015 ] [ -0.15674 0.1559599 -0.4268515 ] [ -0.0983636 0.2938042 0.1625263 ] [ -0.4025144 -0.7553683 0.2814626 ] [ -0.191706 0.7334243 0.5083882 ] [ 0.4828342 -0.6481773 -0.2431241 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.871813893216678e-10 3.530511540649497e-10 -4.524570809788512e-10 ] [ -2.51125163544192e-10 2.498753055623059e-10 -6.838914938534112e-10 ] [ -1.575958602577229e-10 4.707262203328473e-10 2.603958381251271e-10 ] [ -6.448991612153396e-10 -1.210233430353441e-09 4.509527973495821e-10 ] [ -3.071468712670848e-10 1.175075266586606e-09 8.145276883305946e-10 ] [ 7.735856669626713e-10 -1.038494516193268e-09 -3.895277489730413e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.222581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.958273352403429e-18 } }