{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.0000649 7.0864651 2.3583952 ] [ 22.6024434 -24.0354165 -26.1172133 ] [ -22.0705772 -7.8009296 33.8413411 ] [ -2.3288729 13.584146 -22.649371 ] [ 12.7970716 11.165735 12.5668481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.762404681006269e-08 1.135376870733513e-08 3.77856565204694e-09 ] [ 3.621310638843526e-08 -3.850898238749057e-08 -4.184438854970682e-08 ] [ -3.536096279740152e-08 -1.24984670256267e-08 5.421980552693816e-08 ] [ -3.731265713194696e-09 2.176420113473384e-08 -3.628829269202552e-08 ] [ 2.050316893222365e-08 1.788947957104829e-08 2.01343102229649e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3705349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.002368837170466e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5095455 3.310954 2.3762626 ] [ 3.1688743 0.6002871 1.1799012 ] [ 1.0487579 0.877163 2.4645748 ] [ 1.5490258 2.3034634 0.3449171 ] [ 2.919867 2.6862593 2.5247707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.095455e-11 3.310954e-10 2.3762626e-10 ] [ 3.1688743e-10 6.002871e-11 1.1799012e-10 ] [ 1.0487579e-10 8.77163e-11 2.4645748e-10 ] [ 1.5490258e-10 2.3034634e-10 3.449171e-11 ] [ 2.919867e-10 2.6862593e-10 2.5247707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.86e-05 4.01e-05 4.1e-06 ] [ -2.51e-05 4.5e-05 4.17e-05 ] [ 6.53e-05 6.2e-06 -6.1e-05 ] [ 4.6e-06 -3e-05 7.12e-05 ] [ -6.34e-05 -6.13e-05 -5.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.980048514688e-14 6.424728249408e-14 6.568924145279999e-15 ] [ -4.021463318208e-14 7.209794793600001e-14 6.681076508736e-14 ] [ 1.0462213333824e-13 9.93349504896e-15 -9.773277386880001e-14 ] [ 7.370012455680001e-15 -4.8065298624e-14 1.1407497540096e-13 ] [ -1.0157799775872e-13 -9.821342685504e-14 -8.97218907648e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }