{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7621364 -0.275455 -0.2039675 ] [ 0.9635893 -0.9245142 -0.1582602 ] [ -0.9635893 0.9245142 0.1582602 ] [ 0.3026526 1.0425647 -0.1254974 ] [ 0.4594837 -0.7671098 0.3294649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.221077132000878e-09 -4.4132756471847e-10 -3.26791962595395e-10 ] [ 1.543840261232416e-09 -1.481235049041203e-09 -2.535607945321667e-10 ] [ -1.543840261232416e-09 1.481235049041203e-09 2.535607945321667e-10 ] [ 4.849029239393483e-10 1.67037280177322e-09 -2.010690019077516e-10 ] [ 7.361740478438657e-10 -1.229045397272413e-09 5.278609645031466e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.791571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.088129636435201e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2581348 2.5953629 3.2195193 ] [ 2.2920451 3.3251037 1.0436999 ] [ 4.1231852 4.0567485 -0.1307953 ] [ 3.9812485 2.705336 4.7316867 ] [ 5.9783695 3.8033438 4.4602105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2581348e-10 2.5953629e-10 3.2195193e-10 ] [ 2.2920451e-10 3.3251037e-10 1.0436999e-10 ] [ 4.1231852e-10 4.056748500000001e-10 -1.307953e-11 ] [ 3.9812485e-10 2.705336e-10 4.7316867e-10 ] [ 5.9783695e-10 3.8033438e-10 4.4602105e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -3.4e-06 7.1e-06 ] [ 6.3e-06 6.9e-06 1e-07 ] [ 1.04e-05 -2.7e-06 1.4e-05 ] [ -1.07e-05 -1.41e-05 4.9e-06 ] [ 1.6e-06 1.33e-05 -2.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.21765424184e-14 -5.4474005556e-15 1.13754541014e-14 ] [ 1.00937127942e-14 1.10550187746e-14 1.602176634e-16 ] [ 1.66626369936e-14 -4.3258769118e-15 2.243047287599999e-14 ] [ -1.71432899838e-14 -2.25906905394e-14 7.850665506599998e-15 ] [ 2.5634826144e-15 2.13089492322e-14 -4.197702781079999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }