{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.051005 1.466214 2.567615 ] [ 0.3372835 2.721373 0.2523551 ] [ 2.822669 2.541764 0.4147021 ] [ 2.595922 2.673872 2.566842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.051005e-10 1.466214e-10 2.567615e-10 ] [ 3.372835e-11 2.721373e-10 2.523551e-11 ] [ 2.822669e-10 2.541764e-10 4.147021e-11 ] [ 2.595922e-10 2.673872e-10 2.566842e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2388364 -4.5264912 0.287435 ] [ 1.552425 -1.2032936 1.3217669 ] [ 0.2828248 1.2137605 -3.4340379 ] [ 6.4035865 4.5160243 1.824836 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.320007117142868e-08 -7.25223843464662e-09 4.6052164079379e-10 ] [ 2.487259061037449e-09 -1.927888889761742e-09 2.117704042774614e-09 ] [ 4.531352860757231e-10 1.944658712372157e-09 -5.501935283650428e-09 ] [ 1.025967666409784e-08 7.235468612036205e-09 2.923709600082023e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.322575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333423519971255e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6922512 1.7670952 2.5451115 ] [ 0.5124082 2.2648248 0.3078519 ] [ 2.7111784 2.9345459 0.3556536 ] [ 2.8910417 2.4367571 2.5928972 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.922512e-11 1.7670952e-10 2.5451115e-10 ] [ 5.124082e-11 2.2648248e-10 3.078519e-11 ] [ 2.7111784e-10 2.9345459e-10 3.556536e-11 ] [ 2.8910417e-10 2.4367571e-10 2.5928972e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.24e-05 -1.89e-05 -8.9e-06 ] [ -3.42e-05 1.6e-05 -6.9e-06 ] [ 1.75e-05 -1.61e-05 -1.38e-05 ] [ 4.3e-06 1.9e-05 2.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.98669902616e-14 -3.02811383826e-14 -1.42593720426e-14 ] [ -5.479444088279999e-14 2.5634826144e-14 -1.10550187746e-14 ] [ 2.8038091095e-14 -2.579504380739999e-14 -2.21100375492e-14 ] [ 6.8893595262e-15 3.0441356046e-14 4.74244283664e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.595935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.697655947238279e-18 } }