{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3876199 -0.6056793 -0.7678247 ] [ -1.7680746 -0.3462123 1.5735478 ] [ -2.3033757 -0.1055741 -0.8975349 ] [ 0.4223155 1.8666686 0.1633093 ] [ 0.6567836 -0.9367937 -2.681967 ] [ 2.4157137 -0.9189903 2.3778528 ] [ 1.9642574 1.046581 0.2326166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.223212162336834e-09 -9.704052141625095e-10 -1.230190783212774e-09 ] [ -2.832767787950312e-09 -5.546932528933958e-10 2.521101496871275e-09 ] [ -3.690414695458835e-09 -1.691483547820013e-10 -1.438009433132066e-09 ] [ 6.766240207014624e-10 2.990732789701467e-09 2.616503424192135e-10 ] [ 1.052283328844859e-09 -1.500908964652729e-09 -4.296984825157114e-09 ] [ 3.870400012686265e-09 -1.472384773401978e-09 3.809740163863818e-09 ] [ 3.147087283513394e-09 1.676807609973485e-09 3.726928781299853e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.414273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.751380079362868e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6201098 1.5886805 2.7899717 ] [ 2.3907355 2.2732282 4.9088419 ] [ 2.3613213 3.6257362 1.7668865 ] [ 2.6314086 4.4365095 4.0063936 ] [ 3.833192 1.6467032 1.8709579 ] [ 4.5737783 1.8248818 4.1437287 ] [ 4.5995075 3.8047025 2.7926768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6201098e-10 1.5886805e-10 2.7899717e-10 ] [ 2.3907355e-10 2.2732282e-10 4.9088419e-10 ] [ 2.3613213e-10 3.6257362e-10 1.7668865e-10 ] [ 2.6314086e-10 4.4365095e-10 4.0063936e-10 ] [ 3.833192e-10 1.6467032e-10 1.8709579e-10 ] [ 4.5737783e-10 1.8248818e-10 4.1437287e-10 ] [ 4.5995075e-10 3.8047025e-10 2.7926768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.33e-05 -1.5e-05 -1.87e-05 ] [ -1e-07 4.93e-05 1.59e-05 ] [ -1.17e-05 -8e-06 -2.69e-05 ] [ -1.97e-05 8e-07 3.38e-05 ] [ 7.8e-06 -3.6e-06 -1.77e-05 ] [ 3.46e-05 -3.43e-05 5.5e-06 ] [ 1.24e-05 1.09e-05 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.733071526464e-14 -2.4032649312e-14 -2.996070280896e-14 ] [ -1.6021766208e-16 7.898730740544e-14 2.547460827072e-14 ] [ -1.874546646336e-14 -1.28174129664e-14 -4.309855109952001e-14 ] [ -3.156287942976e-14 1.28174129664e-15 5.415356978304e-14 ] [ 1.249697764224e-14 -5.76783583488e-15 -2.835852618816e-14 ] [ 5.543531107968001e-14 -5.495465809344e-14 8.8119714144e-15 ] [ 1.986699009792e-14 1.746372516672e-14 1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }