{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9638956 -1.1378781 0.2592132 ] [ 0.2855145 0.914523 -0.4288687 ] [ 0.2402381 -0.2730638 -0.1224572 ] [ -0.2855145 -0.914523 0.4288687 ] [ 0.1343946 -0.1860304 -1.1072193 ] [ 1.0016515 1.8893836 -1.4742427 ] [ -0.4123886 -0.2924113 2.444706 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.54433100793541e-09 -1.823081704160315e-09 4.153053322643687e-10 ] [ 4.57444660568193e-10 1.465227381855582e-09 -6.871234101939558e-10 ] [ 3.849038704165553e-10 -4.374964399512492e-10 -1.961980645050648e-10 ] [ -4.57444660568193e-10 -1.465227381855582e-09 6.871234101939558e-10 ] [ 2.153238878557764e-10 -2.980535600936736e-10 -1.773960891173836e-09 ] [ 1.604822628711051e-09 3.027126256582802e-09 -2.361997206785072e-09 ] [ -6.607193790479723e-10 -4.684945523775641e-10 3.916850830199604e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.533661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.847896215867707e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5666657 1.4372999 4.1076173 ] [ 1.9581081 5.3493009 1.9860227 ] [ 3.3612228 2.566522 0.2433984 ] [ 1.3338119 3.3496361 2.9237723 ] [ 2.7637982 1.0452237 1.8547802 ] [ 4.0019889 5.2764844 4.3054795 ] [ 3.0607315 3.38877 5.2101245 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5666657e-10 1.4372999e-10 4.1076173e-10 ] [ 1.9581081e-10 5.3493009e-10 1.9860227e-10 ] [ 3.3612228e-10 2.566522e-10 2.433984e-11 ] [ 1.3338119e-10 3.3496361e-10 2.9237723e-10 ] [ 2.7637982e-10 1.0452237e-10 1.8547802e-10 ] [ 4.0019889e-10 5.2764844e-10 4.3054795e-10 ] [ 3.0607315e-10 3.38877e-10 5.2101245e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 8e-06 -5.3e-06 ] [ -1.2e-06 -3.8e-06 1.8e-06 ] [ 1.6e-06 7.1e-06 1.7e-06 ] [ 1.2e-06 3.8e-06 -1.8e-06 ] [ -3.5e-06 -1.08e-05 6.3e-06 ] [ 3.9e-06 7.3e-06 -4.7e-06 ] [ -5.1e-06 -1.16e-05 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-15 1.2817413072e-14 -8.4915361602e-15 ] [ -1.9226119608e-15 -6.088271209199999e-15 2.8839179412e-15 ] [ 2.5634826144e-15 1.13754541014e-14 2.7237002778e-15 ] [ 1.9226119608e-15 6.088271209199999e-15 -2.8839179412e-15 ] [ -5.607618218999999e-15 -1.73035076472e-14 1.00937127942e-14 ] [ 6.248488872599999e-15 1.16958894282e-14 -7.530230179799999e-15 ] [ -8.1711008334e-15 -1.85852489544e-14 3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.329741 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.135659956747179e-18 } }