{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.8628135 -13.6921241 -17.98081 ] [ -0.8022669 0.9704218 -1.0940934 ] [ 30.1701809 -15.932136 0.7393092 ] [ -18.1495204 23.0159715 18.2192219 ] [ 3.6444198 5.6378669 0.1163722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.381285230901062e-08 -2.193720112211224e-08 -2.880843340504685e-08 ] [ -1.285373270821691e-09 1.554787120274653e-09 -1.752930866451583e-09 ] [ 4.83379584832867e-08 -2.552609581860603e-08 1.184503915782351e-09 ] [ -2.907873726361266e-08 3.687565144229911e-08 2.919041137734736e-08 ] [ 5.839004199940612e-09 9.032858538362172e-09 1.864488181510618e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 7.0299753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.126326207046147e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1702565 0.2559986 2.0431055 ] [ -0.2174359 3.0684648 1.0221633 ] [ 3.2949362 -1.6322656 2.1529605 ] [ 1.5281847 2.3627083 2.1692986 ] [ 2.6523391 3.7656689 3.4464171 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1702565e-10 2.559986e-11 2.0431055e-10 ] [ -2.174359e-11 3.0684648e-10 1.0221633e-10 ] [ 3.2949362e-10 -1.6322656e-10 2.1529605e-10 ] [ 1.5281847e-10 2.3627083e-10 2.1692986e-10 ] [ 2.6523391e-10 3.7656689e-10 3.4464171e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0240173 -0.0348212 0.0021279 ] [ -0.0162729 0.0014176 -0.0097451 ] [ -0.0177653 0.0121824 -0.0049754 ] [ 0.0258556 0.0301313 0.0249425 ] [ -0.0158346 -0.0089102 -0.0123499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.847995655473984e-11 -5.578971254820095e-11 3.409271631400319e-12 ] [ -2.607205993261632e-11 2.27124557764608e-12 -1.561337138735808e-11 ] [ -2.846314832149825e-11 1.951835646523392e-11 -7.97146955912832e-12 ] [ 4.142523783675648e-11 4.827566441431104e-11 3.9962290364304e-11 ] [ -2.536982591971968e-11 -1.427571412665216e-11 -1.978672104921792e-11 ] ] } "relaxed-potential-energy" { "source-value" -10.273592 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.646010891403792e-18 } }