{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8087814 -0.7664564 -1.8196336 ] [ 2.3652835 0.4767651 -1.6547307 ] [ -1.1316891 -0.7987076 -0.7390711 ] [ -0.3230348 -0.5654175 0.3348507 ] [ 1.3098891 0.0561721 1.1833867 ] [ -1.1081796 0.5497929 1.8594854 ] [ 0.6965122 1.0478513 0.8357127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.897987295093807e-09 -1.227998535059758e-09 -2.915374436361302e-09 ] [ 3.789601956485739e-09 7.638619031266733e-10 -2.651170863102463e-09 ] [ -1.813165832972489e-09 -1.279670654118218e-09 -1.184122447284677e-09 ] [ -5.175588085288632e-10 -9.05898706954695e-10 5.364899674185438e-10 ] [ 2.098673709151289e-09 8.999762610271139e-11 1.895994519726368e-09 ] [ -1.775499461395466e-09 8.808653379190985e-10 2.979224059144144e-09 ] [ 1.115935572135935e-09 1.678842868766524e-09 1.338959360677052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.643483005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.826797621421364e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5959557 1.7440162 2.5511638 ] [ 2.5799574 4.4884608 4.338436 ] [ 1.3261412 3.6554023 2.4888266 ] [ 4.0132552 2.7708245 1.0656884 ] [ 3.7989905 2.5433332 4.3258836 ] [ 3.3777514 4.8460776 2.0991751 ] [ 5.2670636 3.6038756 2.9153095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5959557e-10 1.7440162e-10 2.5511638e-10 ] [ 2.5799574e-10 4.488460800000001e-10 4.338436e-10 ] [ 1.3261412e-10 3.6554023e-10 2.4888266e-10 ] [ 4.0132552e-10 2.7708245e-10 1.0656884e-10 ] [ 3.7989905e-10 2.5433332e-10 4.3258836e-10 ] [ 3.3777514e-10 4.8460776e-10 2.0991751e-10 ] [ 5.267063600000001e-10 3.6038756e-10 2.9153095e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 6.1e-06 9.7e-06 ] [ -3.5e-06 -1.09e-05 1.49e-05 ] [ -2.3e-06 -1.27e-05 -1.67e-05 ] [ -6e-06 -1.11e-05 2.7e-06 ] [ -1.28e-05 1.37e-05 -6.5e-06 ] [ -4.2e-06 2.43e-05 7.1e-06 ] [ 2.93e-05 -9.4e-06 -1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 9.773277467399999e-15 1.55411133498e-14 ] [ -5.607618218999999e-15 -1.74637253106e-14 2.38724318466e-14 ] [ -3.685006258199999e-15 -2.03476432518e-14 -2.67563497878e-14 ] [ -9.613059803999999e-15 -1.77841606374e-14 4.3258769118e-15 ] [ -2.05078609152e-14 2.19498198858e-14 -1.0414148121e-14 ] [ -6.729141862799999e-15 3.893289220619999e-14 1.13754541014e-14 ] [ 4.69437753762e-14 -1.50604603596e-14 -1.79443783008e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }