{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6838443 -6.9645032 -9.6271907 ] [ 0.8012699 -1.4248437 17.2021308 ] [ -10.6453173 10.3804451 -1.6025334 ] [ 1.2306408 -6.6500909 -3.0642911 ] [ 5.2183351 -0.1524674 2.1665688 ] [ 4.5696614 0.8449407 -9.0194271 ] [ 5.5092545 3.9665194 3.9447427 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.070869916275408e-08 -1.115836429445823e-08 -1.54244599906021e-08 ] [ 1.283775911307517e-09 -2.282851283242106e-09 2.756085202277172e-08 ] [ -1.705567863957597e-08 1.663130658973979e-08 -2.567541568684575e-09 ] [ 1.971703934607067e-09 -1.065462025395603e-08 -4.909535600194157e-09 ] [ 8.360694565602053e-09 -2.442797057267316e-10 3.471225907313418e-09 ] [ 7.321404720371728e-09 1.353744246655604e-09 -1.445071535168638e-08 ] [ 8.826798830659352e-09 6.355064700987699e-09 6.320174581082072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.493171 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.001626666076641e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2845136 2.0754202 2.4262171 ] [ 2.7233447 2.6494098 4.3147083 ] [ 1.8862183 4.4330562 2.4025314 ] [ 3.5765317 1.3489675 2.0520942 ] [ 5.1135785 2.6681172 3.4054373 ] [ 4.1839024 3.7907374 1.3153859 ] [ 3.9494998 4.7920038 3.6468009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2845136e-10 2.0754202e-10 2.4262171e-10 ] [ 2.7233447e-10 2.6494098e-10 4.3147083e-10 ] [ 1.8862183e-10 4.4330562e-10 2.4025314e-10 ] [ 3.5765317e-10 1.3489675e-10 2.0520942e-10 ] [ 5.1135785e-10 2.6681172e-10 3.4054373e-10 ] [ 4.1839024e-10 3.7907374e-10 1.3153859e-10 ] [ 3.9494998e-10 4.7920038e-10 3.6468009e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.52e-05 -2.39e-05 3.34e-05 ] [ -4.79e-05 -4.82e-05 3.72e-05 ] [ -4.43e-05 -5.55e-05 -1.15e-05 ] [ -8.1e-06 1.97e-05 -1.45e-05 ] [ -1.52e-05 5.04e-05 7.42e-05 ] [ 7.68e-05 7.48e-05 -0.0001219 ] [ 0.0001139 -1.72e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.204836828768e-13 -3.82920215526e-14 5.351269957559999e-14 ] [ -7.674426076859999e-14 -7.72249137588e-14 5.96009707848e-14 ] [ -7.09764248862e-14 -8.892080318699998e-14 -1.8425031291e-14 ] [ -1.29776307354e-14 3.15628796898e-14 -2.3231561193e-14 ] [ -2.43530848368e-14 8.074970235359998e-14 1.188815062428e-13 ] [ 1.230471654912e-13 1.198428122232e-13 -1.953053316846e-13 ] [ 1.824879186126e-13 -2.75574381048e-14 4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.095233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.540046603538572e-18 } }