{ "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" [ [ 0.6852315 0.2393985 0.4264483 ] [ 0.2220788 0.5090328 2.375346 ] [ 0.2247887 2.304208 0.7234447 ] [ 2.310751 0.3633962 2.825111 ] [ 2.727094 1.886457 0.3477298 ] [ 2.582747 2.923748 2.275544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.852315e-11 2.393985e-11 4.264483e-11 ] [ 2.220788e-11 5.090328e-11 2.375346e-10 ] [ 2.247887e-11 2.304208e-10 7.234447000000001e-11 ] [ 2.310751e-10 3.633962e-11 2.825111e-10 ] [ 2.727094e-10 1.886457e-10 3.477298e-11 ] [ 2.582747e-10 2.923748e-10 2.275544e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0244157 -8.8187693 -8.7918552 ] [ -3.4482642 -9.9123565 16.1837331 ] [ -3.9549859 20.2650193 -7.6388625 ] [ 3.2854592 4.2421299 0.9202833 ] [ 3.1505088 -1.5053308 -2.1207627 ] [ -2.0571336 -4.2706927 1.447464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.845648126120467e-09 -1.412922599668878e-08 -1.408610485489891e-08 ] [ -5.524728283581616e-09 -1.588134584133492e-08 2.592919881008711e-08 ] [ -6.336585944573647e-09 3.246814014252078e-08 -1.223880690700584e-08 ] [ 5.263885918832271e-09 6.796641348176642e-09 1.474456387772673e-09 ] [ 5.047671542984663e-09 -2.411805814330161e-09 -3.397836416204684e-09 ] [ -3.295891359782139e-09 -6.842403998561228e-09 2.319092980249652e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.40599 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.827441051507859e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7185921 0.2050944 -0.0993892 ] [ 0.331055 0.298033 2.3665945 ] [ 0.36108 2.4817235 1.0751898 ] [ 2.1825115 0.8043256 3.7016448 ] [ 2.5128792 1.9225519 -0.2467759 ] [ 2.6465732 2.5145122 2.1763598 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.185921e-11 2.050944e-11 -9.93892e-12 ] [ 3.31055e-11 2.98033e-11 2.3665945e-10 ] [ 3.6108e-11 2.4817235e-10 1.0751898e-10 ] [ 2.1825115e-10 8.043256e-11 3.7016448e-10 ] [ 2.5128792e-10 1.9225519e-10 -2.467759e-11 ] [ 2.6465732e-10 2.5145122e-10 2.1763598e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-05 -4.29e-05 -1.33e-05 ] [ -4.25e-05 -2.63e-05 -3.6e-06 ] [ -5.17e-05 4.69e-05 3.62e-05 ] [ 1.05e-05 8.1e-06 3.68e-05 ] [ 4.09e-05 1.59e-05 -6.84e-05 ] [ 3.29e-05 -1.6e-06 1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-14 -6.873337703232e-14 -2.130894905664e-14 ] [ -6.8092506384e-14 -4.213724512704e-14 -5.76783583488e-15 ] [ -8.283253129536002e-14 7.514208351552e-14 5.799879367296e-14 ] [ 1.68228545184e-14 1.297763062848e-14 5.896009964544001e-14 ] [ 6.552902379072e-14 2.547460827072e-14 -1.0958888086272e-13 ] [ 5.271161082432e-14 -2.56348259328e-15 1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.311101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.25419711649075e-18 } }