{ "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" [ [ 1.382185 0.3943114 1.075216 ] [ 0.9807846 1.486461 2.753824 ] [ 0.491957 1.894504 0.6685531 ] [ 1.794418 2.681383 2.23804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.382185e-10 3.943114e-11 1.075216e-10 ] [ 9.807846e-11 1.486461e-10 2.753824e-10 ] [ 4.91957e-11 1.894504e-10 6.685531000000001e-11 ] [ 1.794418e-10 2.681383e-10 2.23804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 11.7657799 -22.2727558 -1.473014 ] [ -28.3802542 -37.9992429 27.6870248 ] [ -13.7981878 17.0742194 -11.7134609 ] [ 30.4126621 43.1977793 -14.5005499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.885085763656685e-08 -3.568488891754797e-08 -2.360028612354876e-09 ] [ -4.547018014622035e-08 -6.088149908407039e-08 4.435950419953852e-08 ] [ -2.210713408470386e-08 2.73559153664695e-08 -1.876703335725261e-08 ] [ 4.872645659435737e-08 6.921047263514887e-08 -2.323244222993104e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.285461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.647912528411827e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2226335 -0.1689693 0.9860883 ] [ 1.0042333 1.1938403 2.9180986 ] [ 0.6390528 2.096465 0.5800715 ] [ 1.783425 3.3353234 2.2513747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2226335e-10 -1.689693e-11 9.860883e-11 ] [ 1.0042333e-10 1.1938403e-10 2.9180986e-10 ] [ 6.390528e-11 2.096465e-10 5.800715e-11 ] [ 1.783425e-10 3.3353234e-10 2.2513747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 -3.4e-06 2.3e-06 ] [ -1e-07 -1.8e-06 -1.3e-06 ] [ 1e-07 5.8e-06 1.1e-06 ] [ -1e-06 -7e-07 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-15 -5.4474005556e-15 3.685006258199999e-15 ] [ -1.602176634e-16 -2.8839179412e-15 -2.0828296242e-15 ] [ 1.602176634e-16 9.2926244772e-15 1.7623942974e-15 ] [ -1.602176634e-15 -1.1215236438e-15 -3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.026357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606399490954234e-18 } }