{ "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" [ [ -6.7467934 -6.0725586 -28.6733524 ] [ 23.9756187 32.4968081 3.338087 ] [ -34.5773338 -23.9385387 -5.521201 ] [ 5.7728547 -12.8809231 -11.3052789 ] [ 15.788701 -3.2238188 29.9477577 ] [ -10.4522429 13.9897824 4.1978678 ] [ 6.2391956 -0.3707513 8.0161196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.080955473990541e-08 -9.729311497515752e-09 -4.593977523372781e-08 ] [ 3.841317606683345e-08 5.206562661740193e-08 5.348204993659157e-09 ] [ -5.539899628037842e-08 -3.835376735724473e-08 -8.845939233817434e-09 ] [ 9.249132911817079e-09 -2.063751401517085e-08 -1.811305369443322e-08 ] [ 2.529628782341243e-08 -5.165127153609919e-09 4.798159762763357e-08 ] [ -1.67463393472724e-08 2.241410247602444e-08 6.725725701780984e-09 ] [ 9.99629340527561e-09 -5.940090698851241e-10 1.284323951846942e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.21857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.797413072089338e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4253853 2.3174489 1.830116 ] [ 2.3567699 5.0461716 4.1113954 ] [ 0.7488277 3.0160902 3.753862 ] [ 4.837029 2.5317621 0.7634548 ] [ 3.4107271 2.6096387 4.3237564 ] [ 3.6211375 4.7345193 1.8793288 ] [ 5.5592386 3.3963591 3.1225696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4253853e-10 2.3174489e-10 1.830116e-10 ] [ 2.3567699e-10 5.0461716e-10 4.1113954e-10 ] [ 7.488277e-11 3.0160902e-10 3.753862e-10 ] [ 4.837029000000001e-10 2.5317621e-10 7.634548e-11 ] [ 3.4107271e-10 2.6096387e-10 4.3237564e-10 ] [ 3.6211375e-10 4.7345193e-10 1.8793288e-10 ] [ 5.5592386e-10 3.3963591e-10 3.1225696e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.68e-05 -2.91e-05 -4.9e-06 ] [ 7.6e-06 -1.7e-05 1.22e-05 ] [ 2.04e-05 1.37e-05 -1.22e-05 ] [ 1.66e-05 1.15e-05 -1.28e-05 ] [ -2.35e-05 3.94e-05 -1e-06 ] [ -2.75e-05 -7.4e-06 1.26e-05 ] [ 3.32e-05 -1.12e-05 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.293833379119999e-14 -4.66233400494e-14 -7.850665506599998e-15 ] [ 1.21765424184e-14 -2.723700277799999e-14 1.95465549348e-14 ] [ 3.26844033336e-14 2.19498198858e-14 -1.95465549348e-14 ] [ 2.65961321244e-14 1.8425031291e-14 -2.05078609152e-14 ] [ -3.765115089899999e-14 6.31257593796e-14 -1.602176634e-15 ] [ -4.4059857435e-14 -1.18561070916e-14 2.01874255884e-14 ] [ 5.31922642488e-14 -1.79443783008e-14 9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.452101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917658487440803e-18 } }