{ "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" [ [ 2.096068 2.7039 2.040826 ] [ 2.700744 4.841018 2.002574 ] [ 4.164753 1.488214 0.9121723 ] [ 3.472077 2.802445 4.029704 ] [ 4.572692 3.360808 2.141211 ] [ 3.154153 3.397307 0.264031 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.096068e-10 2.7039e-10 2.040826e-10 ] [ 2.700744e-10 4.841018000000001e-10 2.002574e-10 ] [ 4.164753e-10 1.488214e-10 9.121723000000001e-11 ] [ 3.472077e-10 2.802445e-10 4.029704e-10 ] [ 4.572692e-10 3.360808e-10 2.141211e-10 ] [ 3.154153e-10 3.397307e-10 2.64031e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1181297 -5.3010355 3.7972947 ] [ -1.3136704 6.0560327 4.8615429 ] [ 1.9043047 -6.0483201 -1.1764047 ] [ -1.3453287 1.6347728 -0.5185407 ] [ 9.0346586 1.8355837 4.0692575 ] [ -1.1618346 1.8229665 -11.0331498 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.140450098916212e-08 -8.49319514413084e-09 6.083936790627751e-09 ] [ -2.104732002316984e-09 9.7028340067403e-09 7.789050375396233e-09 ] [ 3.051032469219558e-09 -9.690477059334717e-09 -1.884808106939238e-09 ] [ -2.155454190431257e-09 2.619194760479754e-09 -8.307937864732666e-10 ] [ 1.447511878582966e-08 2.940929289661561e-09 6.519669230515056e-09 ] [ -1.86146423335652e-09 2.920714306801603e-09 -1.76770546633442e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.522819 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.487029769071004e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1132975 2.3541362 2.0361767 ] [ 2.7028273 4.8180542 2.2275531 ] [ 4.0604675 1.2918216 0.8410837 ] [ 3.3116765 3.1489735 4.1050837 ] [ 4.783346 3.3681427 2.0717589 ] [ 3.1888722 3.6125638 0.1088622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1132975e-10 2.3541362e-10 2.0361767e-10 ] [ 2.7028273e-10 4.8180542e-10 2.2275531e-10 ] [ 4.0604675e-10 1.2918216e-10 8.410837e-11 ] [ 3.3116765e-10 3.1489735e-10 4.1050837e-10 ] [ 4.783346e-10 3.3681427e-10 2.0717589e-10 ] [ 3.1888722e-10 3.612563800000001e-10 1.088622e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 4.1e-06 6.64e-05 ] [ 3.66e-05 -5.67e-05 4.9e-05 ] [ -2.02e-05 3.97e-05 -2.18e-05 ] [ -3.7e-06 2.45e-05 -0.0001274 ] [ -3.81e-05 2.82e-05 6.13e-05 ] [ 2.82e-05 -3.98e-05 -2.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 6.568924145279999e-15 1.0638452762112e-13 ] [ 5.863966432128e-14 -9.084341439936e-14 7.85066544192e-14 ] [ -3.236396774016e-14 6.360641184576e-14 -3.492745033344e-14 ] [ -5.928053496960001e-15 3.92533272096e-14 -2.0411730148992e-13 ] [ -6.104292925248e-14 4.518138070656001e-14 9.821342685504e-14 ] [ 4.518138070656001e-14 -6.376662950784e-14 -4.4059857072e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.62566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304595024056973e-18 } }