{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.2666937 -5.4522566 2.5179001 ] [ -18.1679488 3.8493408 14.8004582 ] [ 16.8300268 -1.1039463 -19.7315085 ] [ 3.970317 -4.0667385 4.3747903 ] [ 9.6342987 6.7736007 -1.9616401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9653410022575e-08 -8.735478127092285e-09 4.034120706966263e-09 ] [ -2.910826305506834e-08 6.167323886062866e-09 2.37129483005337e-08 ] [ 2.696467568855379e-08 -1.768716967050754e-09 -3.161336187227238e-08 ] [ 6.361149126972978e-09 -6.515633401288207e-09 7.009186797309849e-09 ] [ 1.543584826211657e-08 1.085250476958604e-08 -3.142893932537423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0842211 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.543643614509776e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0732474 0.6931861 0.4765234 ] [ 0.6820248 1.5175683 2.6241641 ] [ 2.128405 1.3834354 -0.4557504 ] [ 2.8208816 1.0869344 3.8380787 ] [ 2.8715473 2.2529693 1.6309319 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.324740000000001e-12 6.931861000000001e-11 4.765234e-11 ] [ 6.820248e-11 1.5175683e-10 2.6241641e-10 ] [ 2.128405e-10 1.3834354e-10 -4.557504e-11 ] [ 2.8208816e-10 1.0869344e-10 3.8380787e-10 ] [ 2.8715473e-10 2.2529693e-10 1.6309319e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.06e-05 1.64e-05 1.3e-05 ] [ -6.24e-05 -5.67e-05 3.1e-05 ] [ 4.3e-06 3.92e-05 2.69e-05 ] [ -1.93e-05 2.39e-05 3.24e-05 ] [ 6.67e-05 -2.28e-05 -0.0001033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.69830723204e-14 2.62756967976e-14 2.082829624199999e-14 ] [ -9.997582196159998e-14 -9.08434151478e-14 4.966747565399999e-14 ] [ 6.8893595262e-15 6.280532405279998e-14 4.309855145459999e-14 ] [ -3.09220090362e-14 3.82920215526e-14 5.19105229416e-14 ] [ 1.068651814878e-13 -3.65296272552e-14 -1.655048462922e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.146626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785886372513688e-18 } }