{ "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" [ [ 0.8164278 0.1663691 0.8726527 ] [ 0.2293415 1.783801 2.502887 ] [ 2.371717 0.4239938 0.3261347 ] [ 1.905698 2.704881 0.8462502 ] [ 2.020767 2.181943 2.752956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.164278e-11 1.663691e-11 8.726527e-11 ] [ 2.293415e-11 1.783801e-10 2.502887e-10 ] [ 2.371717e-10 4.239938e-11 3.261347e-11 ] [ 1.905698e-10 2.704881e-10 8.462502e-11 ] [ 2.020767e-10 2.181943e-10 2.752956e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.4764837 -4.2761583 11.6866445 ] [ -8.1122085 -3.0218854 -0.1006054 ] [ 31.252186 5.6338696 -11.7750251 ] [ 1.6189083 -0.34057 -2.6992284 ] [ 6.7175979 2.004744 2.8882144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.043088670462185e-08 -6.85116091154516e-09 1.872406874776461e-08 ] [ -1.299719090883619e-08 -4.841594178505743e-09 -1.611876211342236e-10 ] [ 5.007152217062192e-08 9.026454232122924e-09 -1.886567007998351e-08 ] [ 2.593777050848662e-09 -5.456532962413799e-10 -4.324640672309205e-09 ] [ 1.076277839198747e-08 3.211953993951696e-09 4.627429625662329e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.9174485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.674267817598349e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5308781 -0.0801362 1.070736 ] [ 0.2180899 1.1998787 2.7836072 ] [ 2.1398293 0.7574832 -0.1039414 ] [ 2.8214273 2.5551735 0.8829376 ] [ 1.6337267 2.8285887 2.6675411 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308781e-11 -8.01362e-12 1.070736e-10 ] [ 2.180899e-11 1.1998787e-10 2.7836072e-10 ] [ 2.1398293e-10 7.574832000000001e-11 -1.039414e-11 ] [ 2.8214273e-10 2.5551735e-10 8.829376e-11 ] [ 1.6337267e-10 2.8285887e-10 2.6675411e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 1.37e-05 5.6e-06 ] [ -4e-07 -4.3e-06 -3.9e-06 ] [ -2.2e-06 -4.9e-06 -2.3e-06 ] [ -1.9e-06 -1.8e-06 6e-07 ] [ -2.2e-06 -2.6e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.07345834478e-14 2.19498198858e-14 8.972189150399999e-15 ] [ -6.408706536e-16 -6.8893595262e-15 -6.248488872599999e-15 ] [ -3.5247885948e-15 -7.850665506599998e-15 -3.685006258199999e-15 ] [ -3.0441356046e-15 -2.8839179412e-15 9.613059803999998e-16 ] [ -3.5247885948e-15 -4.165659248399999e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -12.012367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924593372643268e-18 } }