{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.926304 -1.3076245 -0.5712731 ] [ -6.4810965 2.591724 -0.3004742 ] [ -3.2885651 -2.0146013 2.7808647 ] [ -1.0099175 0.1719292 0.3573346 ] [ 3.1827453 -0.7757098 -2.3019753 ] [ 4.6225054 -0.1927344 -1.4516714 ] [ 1.0480244 1.5270169 1.4871947 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.086279258780736e-09 -2.095045419945933e-09 -9.152804124527452e-10 ] [ -1.038386137499918e-08 4.152399634577015e-09 -4.814127423598428e-10 ] [ -5.268862162607873e-09 -3.227747129686024e-09 4.455436444655419e-09 ] [ -1.618066220767695e-09 2.754609469423127e-10 5.725131466397364e-10 ] [ 5.09932015163332e-09 -1.242824116324813e-09 -3.68817103770514e-09 ] [ 7.406070142418822e-09 -3.087945522480095e-10 -2.325833997326067e-09 ] [ 1.67912020554187e-09 2.446550796903114e-09 2.382748598548639e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.558223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.973355125916138e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4610844 2.8556907 1.1693102 ] [ 1.6095232 5.0368845 2.0835681 ] [ 2.0647703 3.1343994 3.6358676 ] [ 4.8233654 2.847831 0.4668869 ] [ 4.464948 3.0067156 2.9000175 ] [ 3.9814815 5.027161 1.2514801 ] [ 3.4963962 5.1790967 3.7132337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4610844e-10 2.8556907e-10 1.1693102e-10 ] [ 1.6095232e-10 5.036884500000001e-10 2.0835681e-10 ] [ 2.0647703e-10 3.1343994e-10 3.6358676e-10 ] [ 4.8233654e-10 2.847831e-10 4.668869e-11 ] [ 4.464948e-10 3.0067156e-10 2.9000175e-10 ] [ 3.9814815e-10 5.027161000000001e-10 1.2514801e-10 ] [ 3.4963962e-10 5.1790967e-10 3.7132337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-05 2.5e-06 7.2e-06 ] [ 1.13e-05 2.4e-06 1.25e-05 ] [ -1.15e-05 1.52e-05 -1.37e-05 ] [ -3e-06 4.1e-06 2.8e-06 ] [ 4.5e-06 9.9e-06 -2.5e-06 ] [ -1.55e-05 -1.83e-05 -2.33e-05 ] [ -4.8e-06 -1.58e-05 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.0441356046e-14 4.005441585e-15 1.15356717648e-14 ] [ 1.81045959642e-14 3.845223921599999e-15 2.0027207925e-14 ] [ -1.8425031291e-14 2.43530848368e-14 -2.19498198858e-14 ] [ -4.806529901999999e-15 6.568924199399999e-15 4.486094575199999e-15 ] [ 7.209794853e-15 1.58615486766e-14 -4.005441585e-15 ] [ -2.4833737827e-14 -2.93198324022e-14 -3.733071557219999e-14 ] [ -7.690447843199998e-15 -2.53143908172e-14 2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.073267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536527262344328e-18 } }