{ "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" [ [ 2.537066 3.211759 2.539973 ] [ 6.041706 2.511317 2.608179 ] [ 4.688193 2.566304 0.9930699 ] [ 3.947295 1.472235 2.90393 ] [ 4.605333 4.643852 2.971434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.537066e-10 3.211759e-10 2.539973e-10 ] [ 6.041706e-10 2.511317e-10 2.608179e-10 ] [ 4.688193e-10 2.566304e-10 9.930699e-11 ] [ 3.947295e-10 1.472235e-10 2.90393e-10 ] [ 4.605333e-10 4.643852e-10 2.971434e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7368543 1.3832961 -1.1367055 ] [ 2.4592221 1.2715475 3.4847191 ] [ -4.1068466 2.7841358 -1.4594325 ] [ 0.4556279 -0.2420762 1.1915219 ] [ -0.5448577 -5.1969032 -2.080103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.782747353195949e-09 2.216284671063819e-09 -1.821202976834774e-09 ] [ 3.94010815397468e-09 2.037243676736688e-09 5.583135472075218e-09 ] [ -6.57989360773197e-09 4.460677287892305e-09 -2.338268631135696e-09 ] [ 7.299963691642003e-10 -3.878488280921049e-10 1.909028531351195e-09 ] [ -8.729582686028601e-10 -8.326356807600707e-09 -3.332692395455942e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.797761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.370862671438603e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4495349 3.2669199 2.2287465 ] [ 6.2783022 2.4952669 2.577888 ] [ 4.4717368 2.7791854 0.9957257 ] [ 4.0622704 1.7334976 3.1749103 ] [ 4.5577486 4.1305972 3.0393155 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4495349e-10 3.2669199e-10 2.2287465e-10 ] [ 6.2783022e-10 2.4952669e-10 2.577888e-10 ] [ 4.471736800000001e-10 2.7791854e-10 9.957257000000001e-11 ] [ 4.0622704e-10 1.7334976e-10 3.1749103e-10 ] [ 4.5577486e-10 4.130597200000001e-10 3.0393155e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -0.0 -1e-07 ] [ 7e-07 -3e-07 -6e-07 ] [ 4e-07 -3e-07 -4e-07 ] [ -4e-07 -1e-07 3e-07 ] [ -5e-07 8e-07 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 0.0 -1.6021766208e-16 ] [ 1.12152363456e-15 -4.8065298624e-16 -9.6130597248e-16 ] [ 6.408706483200001e-16 -4.8065298624e-16 -6.408706483200001e-16 ] [ -6.408706483200001e-16 -1.6021766208e-16 4.8065298624e-16 ] [ -8.010883104e-16 1.28174129664e-15 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }