{ "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" [ [ 5.5642722 -1.2160545 -1.9935534 ] [ -6.2145205 3.246549 -2.0274006 ] [ -3.8621059 -3.7491402 3.055164 ] [ -7.2565518 1.2188054 5.5388327 ] [ 4.9456976 -1.7223185 -4.5149989 ] [ 4.5760226 -0.5175176 -1.7854165 ] [ 2.2471858 2.7396764 1.7273727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.914946904055773e-09 -1.948334105570553e-09 -3.194024676111255e-09 ] [ -9.956759536613996e-09 5.201544948936066e-09 -3.24825386907758e-09 ] [ -6.187775831013539e-09 -6.006784826030086e-09 4.894912373837975e-09 ] [ -1.162627773737064e-08 1.952741533273023e-09 8.874188331575131e-09 ] [ 7.923881133549877e-09 -2.759458457005929e-09 -7.233825740115702e-09 ] [ 7.331596486375928e-09 -8.291546064037584e-10 -2.860552598258061e-09 ] [ 3.600388581016597e-09 4.389445512801237e-09 2.767556178149492e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.641404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.185593874375413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0617834 2.6569938 0.8724594 ] [ 1.9354689 4.8077983 2.1635241 ] [ 2.006573 2.6072522 3.3723609 ] [ 4.4611846 3.0779512 0.9568366 ] [ 4.4069809 3.0291642 3.4106193 ] [ 4.0423836 5.4791612 0.97233 ] [ 3.9871945 5.429458 3.4722339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0617834e-10 2.6569938e-10 8.724594e-11 ] [ 1.9354689e-10 4.8077983e-10 2.1635241e-10 ] [ 2.006573e-10 2.6072522e-10 3.3723609e-10 ] [ 4.4611846e-10 3.0779512e-10 9.568366e-11 ] [ 4.4069809e-10 3.0291642e-10 3.4106193e-10 ] [ 4.0423836e-10 5.4791612e-10 9.723300000000001e-11 ] [ 3.9871945e-10 5.429458000000001e-10 3.4722339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.17e-05 5.54e-05 -7.71e-05 ] [ -6.6e-06 9.31e-05 -9.01e-05 ] [ 4.94e-05 -8.65e-05 0.0001302 ] [ -8.53e-05 5.41e-05 4.2e-05 ] [ 1.2e-06 -1.27e-05 2.13e-05 ] [ -1.77e-05 -5.73e-05 -4.28e-05 ] [ -2.6e-06 -4.62e-05 1.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.885429831779999e-14 8.876058552359998e-14 -1.235278184814e-13 ] [ -1.05743657844e-14 1.491626446254e-13 -1.443561147234e-13 ] [ 7.91475257196e-14 -1.38588278841e-13 2.086033977468e-13 ] [ -1.366656668802e-13 8.66777558994e-14 6.729141862799998e-14 ] [ 1.9226119608e-15 -2.03476432518e-14 3.41263623042e-14 ] [ -2.83585264218e-14 -9.180472112819998e-14 -6.857315993519999e-14 ] [ -4.165659248399999e-15 -7.40205604908e-14 2.65961321244e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.65628 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.828847925936151e-18 } }