{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.827569 -4.4857715 -0.0646014 ] [ -4.2086238 3.3102762 -2.0831555 ] [ -2.4105341 1.8786181 4.0632243 ] [ -2.0283924 0.5904436 -1.5986924 ] [ 7.8199813 -1.2935664 -0.3167751 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.325911714822746e-09 -7.186998282763131e-09 -1.035028536036876e-10 ] [ -6.742958713656288e-09 5.30364717972631e-09 -3.337583067088587e-09 ] [ -3.862101410480219e-09 3.009878024029475e-09 6.510003032161005e-09 ] [ -3.249842907863181e-09 9.459949396148422e-10 -2.561387608233382e-09 ] [ 1.252899131717694e-08 -2.072521860607497e-09 -5.075296634530133e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4713977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.357267545226134e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.469217 0.0279279 2.39577 ] [ 1.034275 3.434612 0.9108004 ] [ -0.5143614 2.0971079 2.0107813 ] [ 2.625737 0.0866081 1.5337242 ] [ 2.9749623 2.1920535 0.6159626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.69217e-11 2.79279e-12 2.39577e-10 ] [ 1.034275e-10 3.434612e-10 9.108004e-11 ] [ -5.143614e-11 2.0971079e-10 2.0107813e-10 ] [ 2.625737e-10 8.66081e-12 1.5337242e-10 ] [ 2.9749623e-10 2.1920535e-10 6.159626e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 5.1e-06 -4e-07 ] [ -1.9e-06 -7.6e-06 3e-06 ] [ 6.9e-06 2e-07 -2.2e-06 ] [ 2.5e-06 -2.2e-06 -2e-07 ] [ -2.7e-06 4.5e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.690447843199998e-15 8.1711008334e-15 -6.408706536e-16 ] [ -3.0441356046e-15 -1.21765424184e-14 4.806529901999999e-15 ] [ 1.10550187746e-14 3.204353268e-16 -3.5247885948e-15 ] [ 4.005441585e-15 -3.5247885948e-15 -3.204353268e-16 ] [ -4.3258769118e-15 7.209794853e-15 -4.806529901999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.435516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992389316693314e-18 } }