{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5073449 -3.3412795 -3.2209096 ] [ -0.6300844 0.6218695 -1.0535172 ] [ -3.496752 -0.8080745 5.3309221 ] [ -1.9138223 9.1624308 1.4483757 ] [ 7.5480037 -5.6349463 -2.504871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.415032778159067e-09 -5.353319942563202e-09 -5.160466101346286e-09 ] [ -1.00950650312791e-09 9.963447822972628e-10 -1.687920641357104e-09 ] [ -5.602414349292767e-09 -1.294678082431233e-09 8.541078826294211e-09 ] [ -3.066281370688138e-09 1.467983253840192e-08 2.320553703793393e-09 ] [ 1.209323516148554e-08 -9.028179295704755e-09 -4.013245787384214e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2783674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.166123018194733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9222786 0.3989315 2.1922883 ] [ 2.5567826 2.5821236 1.0603668 ] [ 2.1363092 1.5144583 4.4638499 ] [ 2.7708069 3.6976513 3.3319245 ] [ 4.2146817 1.5427931 2.8343326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9222786e-10 3.989315e-11 2.1922883e-10 ] [ 2.5567826e-10 2.5821236e-10 1.0603668e-10 ] [ 2.1363092e-10 1.5144583e-10 4.4638499e-10 ] [ 2.7708069e-10 3.6976513e-10 3.3319245e-10 ] [ 4.2146817e-10 1.5427931e-10 2.8343326e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.11e-05 -1.93e-05 1.59e-05 ] [ 7.3e-06 1.1e-05 -3e-07 ] [ -1.77e-05 -1.65e-05 -1.9e-06 ] [ 7.1e-06 9e-06 -5.2e-06 ] [ 2.45e-05 1.59e-05 -8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.38059269774e-14 -3.09220090362e-14 2.54746084806e-14 ] [ 1.16958894282e-14 1.7623942974e-14 -4.806529901999999e-16 ] [ -2.83585264218e-14 -2.6435914461e-14 -3.0441356046e-15 ] [ 1.13754541014e-14 1.4419589706e-14 -8.331318496799998e-15 ] [ 3.925332753299999e-14 2.54746084806e-14 -1.37787190524e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335170976765e-18 } }