{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.9533413 -7.9956844 -16.2110227 ] [ -17.2024517 7.6643034 11.1400806 ] [ -0.5407589 0.7307421 0.3306612 ] [ 0.0360748 -0.8082161 -0.6699286 ] [ 11.7537945 0.408855 5.4102094 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.53830424650308e-09 -1.281049861297527e-08 -2.59729215691981e-08 ] [ -2.756136593418122e-08 1.227956772219795e-08 1.784837669114764e-08 ] [ -8.663912670695252e-10 1.170777908454296e-09 5.29777644045673e-10 ] [ 5.779820116003584e-11 -1.294904939974155e-09 -1.073343940525275e-09 ] [ 1.883165475358763e-08 6.55057922297184e-10 8.668111014312396e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.450595200765051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.033499282091045e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5010704 2.2288889 -0.0536966 ] [ -0.3258684 3.1005017 1.8965848 ] [ 2.1561339 0.6085075 0.4132006 ] [ 2.4384543 0.3944727 2.6762956 ] [ 1.930785 2.5142827 1.8473011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.010704000000001e-11 2.2288889e-10 -5.36966e-12 ] [ -3.258684e-11 3.1005017e-10 1.8965848e-10 ] [ 2.1561339e-10 6.085075e-11 4.132006e-11 ] [ 2.4384543e-10 3.944727e-11 2.6762956e-10 ] [ 1.930785e-10 2.5142827e-10 1.8473011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.61e-05 -8.2e-06 3.71e-05 ] [ 2.55e-05 1.64e-05 -3.87e-05 ] [ 2.93e-05 2.8e-06 -9.8e-06 ] [ 2.7e-06 -2.3e-05 -3.7e-06 ] [ -2.14e-05 1.2e-05 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.783857601088001e-14 -1.313784829056e-14 5.944075263168e-14 ] [ 4.08555038304e-14 2.627569658112e-14 -6.200423522496e-14 ] [ 4.694377498944e-14 4.48609453824e-15 -1.570133088384e-14 ] [ 4.32587687616e-15 -3.68500622784e-14 -5.928053496960001e-15 ] [ -3.428657968511999e-14 1.92261194496e-14 2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -4.883549399234948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.824308673976119e-19 } }