{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.026114 -0.6749138 -19.5136889 ] [ -6.2987756 -17.3847104 13.0451462 ] [ -10.0007607 7.124325 5.3846439 ] [ 13.5126172 -9.6546974 -2.3811697 ] [ 15.8130331 20.5899966 3.4650685 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.087013531067557e-08 -1.081331111415287e-09 -3.126437614114447e-08 ] [ -1.009175100598549e-08 -2.785337656225862e-08 2.090062825655796e-08 ] [ -1.602298498375544e-08 1.141442695398096e-08 8.627150567913333e-09 ] [ 2.164959936365996e-08 -1.546853045517855e-08 -3.81505442349735e-09 ] [ 2.533527193675655e-08 3.298881117487149e-08 5.551651740170526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.0422535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.078580673846973e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6274006 2.2717475 0.8385886 ] [ 2.1192807 0.9584715 3.9573271 ] [ 1.201066 3.2618645 3.1974204 ] [ 3.7804922 1.4480033 2.0268035 ] [ 3.7256544 3.8345832 3.0404164 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6274006e-10 2.2717475e-10 8.385886000000001e-11 ] [ 2.1192807e-10 9.584715e-11 3.9573271e-10 ] [ 1.201066e-10 3.2618645e-10 3.1974204e-10 ] [ 3.7804922e-10 1.4480033e-10 2.0268035e-10 ] [ 3.7256544e-10 3.8345832e-10 3.0404164e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 -5.4e-06 -7e-06 ] [ -9e-07 4e-07 5.6e-06 ] [ 7e-06 8e-07 4.1e-06 ] [ -8.3e-06 7e-07 -8.1e-06 ] [ -4.1e-06 3.4e-06 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.009371271104e-14 -8.65175375232e-15 -1.12152363456e-14 ] [ -1.44195895872e-15 6.408706483200001e-16 8.972189076479999e-15 ] [ 1.12152363456e-14 1.28174129664e-15 6.568924145279999e-15 ] [ -1.329806595264e-14 1.12152363456e-15 -1.297763062848e-14 ] [ -6.568924145279999e-15 5.44740051072e-15 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }