{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.6115168 -1.0111059 -0.8496758 ] [ 4.8972372 5.1606795 -3.642104 ] [ 2.5173345 -5.1006216 -1.7199996 ] [ -2.3990196 -2.7548544 -1.588126 ] [ 2.6514378 -1.0499108 0.4578492 ] [ 0.5230395 1.8383395 6.6513735 ] [ 1.4214875 2.9174737 0.6906827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.539934750738643e-08 -1.619970234132943e-09 -1.361330702019537e-09 ] [ 7.846238948352053e-09 8.268320042341833e-09 -5.835293879322163e-09 ] [ 4.033214482633258e-09 -8.17209667906749e-09 -2.755743146905351e-09 ] [ -3.843653115960968e-09 -4.413763313388011e-09 -2.544458348084621e-09 ] [ 4.248071654665386e-09 -1.682142537685424e-09 7.335552840919835e-10 ] [ 8.380016586549216e-10 2.945344567993162e-09 1.065667511790867e-08 ] [ 2.27747403925944e-09 4.674308153938873e-09 1.10659567433102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9728205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.597821984853497e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.602039 2.743367 1.7272199 ] [ 0.6520187 2.5033082 2.7472903 ] [ 2.9825762 3.2609727 4.9205257 ] [ 1.0073561 4.0372943 4.3089913 ] [ 5.0329728 1.7446494 1.6634568 ] [ 4.2299458 1.917783 3.7059125 ] [ 3.9669044 4.4608144 1.9319635 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.602039e-10 2.743367e-10 1.7272199e-10 ] [ 6.520187e-11 2.5033082e-10 2.7472903e-10 ] [ 2.9825762e-10 3.2609727e-10 4.9205257e-10 ] [ 1.0073561e-10 4.0372943e-10 4.3089913e-10 ] [ 5.0329728e-10 1.7446494e-10 1.6634568e-10 ] [ 4.2299458e-10 1.917783e-10 3.7059125e-10 ] [ 3.9669044e-10 4.4608144e-10 1.9319635e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.5834427 0.1623607 0.2191667 ] [ 0.5287159 0.4592446 -0.4016112 ] [ -0.2942452 0.3874829 0.2609233 ] [ -0.1694209 -0.4928012 0.2743116 ] [ 0.032624 -0.1274686 0.1365347 ] [ 0.4400814 -0.0498359 -0.2610945 ] [ 0.0456875 -0.3389826 -0.2282306 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.347782535164281e-10 2.601305176767225e-10 3.511437627978874e-10 ] [ 8.470962540252308e-10 7.357909613486477e-10 -6.43452075291433e-10 ] [ -4.714327802226201e-10 6.208160433397843e-10 4.180452110819847e-10 ] [ -2.714422050548948e-10 -7.89554561342185e-10 4.394956323342413e-10 ] [ 5.22694100769792e-11 -2.042272108061069e-10 2.187527042679418e-10 ] [ 7.050881303289332e-10 -7.984591385652672e-11 -4.183195037194657e-10 ] [ 7.31994443628e-11 -5.431099965779981e-10 -3.656657314711565e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.737031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.361132652820485e-18 } }