{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1291037 -1.0714713 0.2227935 ] [ -6.5973015 -7.6822952 -0.9157746 ] [ -10.3738928 3.6527231 8.6771528 ] [ -1.5425801 1.2875868 -0.8668737 ] [ 3.3162483 -1.8903248 -6.4644112 ] [ 11.4850247 -2.4684103 5.1199118 ] [ 3.8416051 8.1721917 -5.7727985 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.06846929798777e-10 -1.716686266718183e-09 3.569545369662048e-10 ] [ -1.057004222366877e-08 -1.230839376352406e-08 -1.467232654042472e-09 ] [ -1.662080851084545e-08 5.8523075530761e-09 1.390233135126926e-08 ] [ -2.471485771931326e-09 2.062941468210686e-09 -1.388884775326393e-09 ] [ 5.313215495027745e-09 -3.028634200278436e-09 -1.035712849187767e-08 ] [ 1.840103806365054e-08 -3.954829273201914e-09 8.203002986518045e-09 ] [ 6.154929877566047e-09 1.309329448243581e-08 -9.24904279328931e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.365025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660660072900752e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1742428 1.6708685 1.8392775 ] [ 2.1408519 0.1443528 3.5512666 ] [ 2.4075532 2.0214107 5.1238355 ] [ 1.6508676 3.5756308 3.3690507 ] [ 4.5438302 0.288037 2.918389 ] [ 4.7295833 2.312165 4.3550124 ] [ 4.0075559 4.0434938 2.7189603 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1742428e-10 1.6708685e-10 1.8392775e-10 ] [ 2.1408519e-10 1.443528e-11 3.5512666e-10 ] [ 2.4075532e-10 2.0214107e-10 5.1238355e-10 ] [ 1.6508676e-10 3.5756308e-10 3.3690507e-10 ] [ 4.5438302e-10 2.88037e-11 2.918389e-10 ] [ 4.7295833e-10 2.312165e-10 4.3550124e-10 ] [ 4.0075559e-10 4.0434938e-10 2.7189603e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 6.2e-06 3e-07 ] [ -9e-07 7.5e-06 -2.3e-06 ] [ 2.9e-06 -5.5e-06 1.2e-05 ] [ 5.8e-06 -8.2e-06 -8.8e-06 ] [ 8.4e-06 -1.02e-05 4e-06 ] [ -8.6e-06 1.9e-06 -5.8e-06 ] [ -1.6e-06 8.3e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-15 9.93349504896e-15 4.8065298624e-16 ] [ -1.44195895872e-15 1.2016324656e-14 -3.68500622784e-15 ] [ 4.646312200320001e-15 -8.8119714144e-15 1.92261194496e-14 ] [ 9.292624400640001e-15 -1.313784829056e-14 -1.409915426304e-14 ] [ 1.345828361472e-14 -1.634220153216e-14 6.4087064832e-15 ] [ -1.377871893888e-14 3.04413557952e-15 -9.292624400640001e-15 ] [ -2.56348259328e-15 1.329806595264e-14 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.049323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.052037995266772e-18 } }