{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.735137 1.403924 2.79869 ] [ 2.045924 2.694064 4.682831 ] [ 2.274394 3.585822 2.431289 ] [ 3.715465 2.312241 1.138099 ] [ 3.875208 1.089856 3.316209 ] [ 4.61535 3.47459 2.663723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.735137e-10 1.403924e-10 2.79869e-10 ] [ 2.045924e-10 2.694064e-10 4.682831e-10 ] [ 2.274394e-10 3.585822e-10 2.431289e-10 ] [ 3.715465e-10 2.312241e-10 1.138099e-10 ] [ 3.875208e-10 1.089856e-10 3.316209e-10 ] [ 4.615350000000001e-10 3.47459e-10 2.663723e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1227791 -0.7549481 -0.266832 ] [ 0.3483198 -0.1349693 -0.320115 ] [ -0.8155196 1.7854654 0.2068641 ] [ -0.594319 -1.699545 -1.8528279 ] [ 1.1546884 -0.038632 0.5035255 ] [ 1.0296094 0.842629 1.7293854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.798890439163549e-09 -1.209560205702695e-09 -4.27511995603488e-10 ] [ 5.580698447195531e-10 -2.162446587673361e-10 -5.128807731929099e-10 ] [ -1.306606447689026e-09 2.860630944695464e-09 3.314328274334394e-10 ] [ -9.52204014942246e-10 -2.72297128743153e-09 -2.968557568203289e-09 ] [ 1.850014774030845e-09 -6.1895287724688e-11 8.067367907231669e-10 ] [ 1.649616122826759e-09 1.350040494930786e-09 2.770780879060743e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.279373 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.768460767077048e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1974601 0.8674557 2.5439982 ] [ 1.8817295 2.5413495 4.2063198 ] [ 2.5948348 4.163345 2.7084734 ] [ 2.9105562 2.489457 1.0461537 ] [ 3.9818943 1.4384514 4.0118762 ] [ 4.6950031 3.0604384 2.5140197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1974601e-10 8.674557000000001e-11 2.5439982e-10 ] [ 1.8817295e-10 2.5413495e-10 4.206319800000001e-10 ] [ 2.5948348e-10 4.163345e-10 2.7084734e-10 ] [ 2.9105562e-10 2.489457e-10 1.0461537e-10 ] [ 3.9818943e-10 1.4384514e-10 4.0118762e-10 ] [ 4.6950031e-10 3.0604384e-10 2.5140197e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 4.4e-06 1.67e-05 ] [ -7.7e-06 -5.9e-06 -8e-07 ] [ 1.16e-05 -6e-07 4e-07 ] [ 1.12e-05 -9.9e-06 -2.7e-06 ] [ 6e-06 -2e-07 -2.36e-05 ] [ -1.02e-05 1.21e-05 1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.74637253106e-14 7.0495771896e-15 2.67563497878e-14 ] [ -1.23367600818e-14 -9.452842140600001e-15 -1.2817413072e-15 ] [ 1.85852489544e-14 -9.613059803999998e-16 6.408706536e-16 ] [ 1.79443783008e-14 -1.58615486766e-14 -4.3258769118e-15 ] [ 9.613059803999999e-15 -3.204353268e-16 -3.78113685624e-14 ] [ -1.63422016668e-14 1.93863372714e-14 1.602176634e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }