{ "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" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6247561 -6.9661376 -7.1810937 ] [ 0.8583228 -5.4940984 5.5810682 ] [ -3.1574255 4.954584 -1.9446711 ] [ -5.9310299 3.027783 5.5041748 ] [ 2.5093341 -1.3537443 0.3087336 ] [ 10.3455545 5.8316134 -2.2682118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.409676100322187e-09 -1.116098279999582e-08 -1.150538043791417e-08 ] [ 1.375184723259594e-09 -8.802516008854686e-09 8.941856989130338e-09 ] [ -5.058753318017751e-09 7.938118650589747e-09 -3.115706571565419e-09 ] [ -9.502557443045763e-09 4.851043135455686e-09 8.818660181356517e-09 ] [ 4.020396428796209e-09 -2.168937468001261e-09 4.946457559754189e-10 ] [ 1.657540554911223e-08 9.343274651023999e-09 -3.634075916982686e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5445734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.281209252989567e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5602468 1.9203713 1.9907835 ] [ 2.4412258 1.5118287 4.1159805 ] [ 1.902771 4.1812194 2.4711315 ] [ 1.5804012 3.6008411 4.7113848 ] [ 4.5523381 2.2068336 3.6710528 ] [ 4.1682022 4.1111977 2.4976409 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5602468e-10 1.9203713e-10 1.9907835e-10 ] [ 2.4412258e-10 1.5118287e-10 4.1159805e-10 ] [ 1.902771e-10 4.1812194e-10 2.4711315e-10 ] [ 1.5804012e-10 3.6008411e-10 4.7113848e-10 ] [ 4.5523381e-10 2.2068336e-10 3.6710528e-10 ] [ 4.1682022e-10 4.1111977e-10 2.4976409e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 6e-07 1e-07 ] [ 3.9e-06 1.99e-05 -8.9e-06 ] [ 8.4e-06 -7.9e-06 2.5e-05 ] [ -2.4e-05 -9.7e-06 1.5e-06 ] [ -1.2e-06 1.61e-05 -3e-06 ] [ 1.66e-05 -1.91e-05 -1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 9.6130597248e-16 1.6021766208e-16 ] [ 6.24848882112e-15 3.188331475392e-14 -1.425937192512e-14 ] [ 1.345828361472e-14 -1.265719530432e-14 4.005441552e-14 ] [ -3.84522388992e-14 -1.554111322176e-14 2.4032649312e-15 ] [ -1.92261194496e-15 2.579504359488e-14 -4.8065298624e-15 ] [ 2.659613190528e-14 -3.060157345728e-14 -2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }