{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9860243 2.8430795 -3.0905512 ] [ -0.2241144 -1.309564 0.611557 ] [ -4.8535947 -1.769739 4.691859 ] [ 12.8033984 -3.9241444 -12.6935984 ] [ 7.0036219 -5.8772912 6.5830983 ] [ -7.537088 7.3739735 -0.3527985 ] [ 0.7938011 2.6636856 4.2504339 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.27950215320162e-08 4.555115543504403e-09 -4.951608918820661e-09 ] [ -3.590708550229295e-10 -2.098152841527576e-09 9.79822335759138e-10 ] [ -7.77631601924624e-09 -2.835434474078526e-09 7.517186859822606e-09 ] [ 2.051330575227299e-08 -6.287172466121949e-09 -2.033738675785978e-08 ] [ 1.122103936155068e-08 -9.416458631853819e-09 1.054728627558512e-08 ] [ -1.207574628200179e-08 1.18144080414352e-08 -5.65245513210249e-10 ] [ 1.271809574463497e-09 4.267694828642269e-09 6.809945878941492e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.36335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.94213302919639e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4066728 1.6819621 1.3268684 ] [ 0.9410737 3.1623531 5.2056075 ] [ 1.997574 1.3071917 3.7797223 ] [ 1.3881836 3.5236251 2.7035253 ] [ 4.3562955 1.5506767 2.9422712 ] [ 3.7476106 3.764674 1.8672869 ] [ 3.3400149 3.3922283 4.3207063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4066728e-10 1.6819621e-10 1.3268684e-10 ] [ 9.410737e-11 3.1623531e-10 5.2056075e-10 ] [ 1.997574e-10 1.3071917e-10 3.7797223e-10 ] [ 1.3881836e-10 3.5236251e-10 2.7035253e-10 ] [ 4.3562955e-10 1.5506767e-10 2.9422712e-10 ] [ 3.7476106e-10 3.764674e-10 1.8672869e-10 ] [ 3.3400149e-10 3.3922283e-10 4.320706300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 0.0001235 0.0002617 ] [ -7.93e-05 -0.0001147 4.94e-05 ] [ 6.1e-06 0.0002041 -0.0001161 ] [ 0.0002627 -5.16e-05 -0.0001595 ] [ -1.34e-05 9.76e-05 -2.25e-05 ] [ -0.0002017 -0.0001704 -4.9e-05 ] [ 4.12e-05 -8.86e-05 3.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4833737827e-14 1.97868814299e-13 4.192896251178e-13 ] [ -1.270526070762e-13 -1.837696599198e-13 7.91475257196e-14 ] [ 9.773277467399999e-15 3.270042509994e-13 -1.860127072074e-13 ] [ 4.208918017517999e-13 -8.267231431439999e-14 -2.55547173123e-13 ] [ -2.14691668956e-14 1.563724394784e-13 -3.6048974265e-14 ] [ -3.231590270777999e-13 -2.730108984336e-13 -7.850665506599998e-14 ] [ 6.600967732079998e-14 -1.419528497724e-13 5.783857648740001e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.837867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.139682677979968e-18 } }