{ "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" [ [ 1.616061 2.621535 1.403689 ] [ 0.7250895 5.039665 2.091083 ] [ 2.961807 4.812326 1.76803 ] [ 3.86556 2.819524 0.0440365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.616061e-10 2.621535000000001e-10 1.403689e-10 ] [ 7.250895e-11 5.039665000000001e-10 2.091083e-10 ] [ 2.961807e-10 4.812326e-10 1.76803e-10 ] [ 3.86556e-10 2.819524e-10 4.40365e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7079603 0.0233825 -0.5886759 ] [ -0.7804566 -0.1220192 0.0959546 ] [ 0.986001 0.2639947 -0.0463898 ] [ -0.9135047 -0.165358 0.5391112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.13427745045963e-09 3.7462895144505e-11 -9.431627719789206e-10 ] [ -1.250429328371084e-09 -1.954963111393728e-10 1.537362180448164e-10 ] [ 1.579747763300634e-09 4.229661398398398e-10 -7.43246536159332e-11 ] [ -1.46359588538918e-09 -2.64932723844972e-10 8.637513677677008e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.73699703709508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079385923616097e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.624848 2.5572118 1.0460316 ] [ 0.7907961 4.9714894 2.3211374 ] [ 2.9594206 5.0893029 1.6074144 ] [ 3.7934528 2.6750458 0.3322552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.624848e-10 2.5572118e-10 1.0460316e-10 ] [ 7.907961000000001e-11 4.9714894e-10 2.3211374e-10 ] [ 2.9594206e-10 5.0893029e-10 1.6074144e-10 ] [ 3.7934528e-10 2.6750458e-10 3.322552e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -3e-06 -1e-07 ] [ 4.1e-06 4.4e-06 1.1e-06 ] [ -5.8e-06 -3.1e-06 -0.0 ] [ 7e-06 1.8e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.4915361602e-15 -4.806529901999999e-15 -1.602176634e-16 ] [ 6.568924199399999e-15 7.0495771896e-15 1.7623942974e-15 ] [ -9.2926244772e-15 -4.9667475654e-15 0.0 ] [ 1.1215236438e-14 2.8839179412e-15 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.562032037095079 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.211571103539316e-18 } }