{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.3744879 -26.2770885 -49.3293178 ] [ -21.570539 21.8673872 41.2769064 ] [ -3.1500539 4.0214821 -1.3370663 ] [ 0.6321552 -0.5349828 -0.1717049 ] [ 11.7139497 0.923202 9.5611827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.982611520775249e-08 -4.210053685739254e-08 -7.903427969917329e-08 ] [ -3.455981328385461e-08 3.503541652982117e-08 6.61328944130299e-08 ] [ -5.046942712839862e-09 6.443124601585687e-09 -2.142216366319559e-09 ] [ 1.012824282157148e-09 -8.571369346901223e-10 -2.751015764568019e-10 ] [ 1.876781634656718e-08 1.479132660675802e-09 1.531870338913742e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3329741 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.942189801551922e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.227197 1.8381175 -0.2756548 ] [ 0.1484709 3.3396708 1.4952995 ] [ 1.8439369 0.2415005 0.208196 ] [ 2.7644111 0.7562941 2.2781864 ] [ 1.7165594 2.6710707 3.0736585 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.27197e-11 1.8381175e-10 -2.756548e-11 ] [ 1.484709e-11 3.3396708e-10 1.4952995e-10 ] [ 1.8439369e-10 2.415005e-11 2.08196e-11 ] [ 2.7644111e-10 7.562941e-11 2.2781864e-10 ] [ 1.7165594e-10 2.6710707e-10 3.0736585e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -9.6e-06 -1.1e-05 ] [ -1.7e-06 1.39e-05 8.9e-06 ] [ 3e-07 -1.5e-06 -1e-06 ] [ 1.13e-05 -1.38e-05 -4.1e-06 ] [ -8.3e-06 1.1e-05 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -1.538089555968e-14 -1.76239428288e-14 ] [ -2.72370025536e-15 2.227025502912e-14 1.425937192512e-14 ] [ 4.8065298624e-16 -2.4032649312e-15 -1.6021766208e-15 ] [ 1.810459581504e-14 -2.211003736704e-14 -6.568924145279999e-15 ] [ -1.329806595264e-14 1.76239428288e-14 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.435516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992389300278433e-18 } }