{ "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" [ [ -3.2305118 -1.7943794 -5.4068483 ] [ 3.8277248 4.2865431 -3.3563972 ] [ -4.70715 -2.1246556 -0.6140702 ] [ 0.4965981 -1.7524779 -1.4003268 ] [ 3.3653984 -1.3037358 4.3928611 ] [ -3.3279685 1.6847516 4.2650331 ] [ 3.575909 1.003954 2.1197484 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.175850521821281e-09 -2.874912747210939e-09 -8.66272600984262e-09 ] [ 6.132691235942322e-09 6.867799195453926e-09 -5.377541168263024e-09 ] [ -7.5416857427331e-09 -3.40407355761725e-09 -9.838489260757068e-10 ] [ 7.956378723087954e-10 -2.807779142981388e-09 -2.243570878923991e-09 ] [ 5.391962680580986e-09 -2.088815035669297e-09 7.038139410827537e-09 ] [ -5.331993369388028e-09 2.699269647614114e-09 6.833336376056585e-09 ] [ 5.729237845110306e-09 1.608511640410836e-09 3.396211356438886e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.32346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.294871293003364e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4512122 2.347274 1.8621066 ] [ 2.3261495 5.0041301 3.9486532 ] [ 0.8911831 2.9665288 3.7309621 ] [ 4.7210974 2.6116553 0.8192756 ] [ 3.4467899 2.6950395 4.3522959 ] [ 3.672043 4.7586682 1.9509571 ] [ 5.45064 3.2686941 3.1202327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4512122e-10 2.347274e-10 1.8621066e-10 ] [ 2.3261495e-10 5.0041301e-10 3.9486532e-10 ] [ 8.911831e-11 2.9665288e-10 3.7309621e-10 ] [ 4.7210974e-10 2.6116553e-10 8.192756000000001e-11 ] [ 3.4467899e-10 2.6950395e-10 4.3522959e-10 ] [ 3.672043e-10 4.7586682e-10 1.9509571e-10 ] [ 5.45064e-10 3.2686941e-10 3.1202327e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.28e-05 -1.35e-05 4.65e-05 ] [ 9.7e-06 -2.7e-06 -1.7e-06 ] [ 1.57e-05 -2.6e-06 -5.8e-06 ] [ 9.4e-06 1.35e-05 -1.67e-05 ] [ -2.56e-05 1.92e-05 -3.26e-05 ] [ -3.3e-06 4.6e-06 1e-05 ] [ -1.87e-05 -1.86e-05 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.05078609152e-14 -2.162938455899999e-14 7.450121348099999e-14 ] [ 1.55411133498e-14 -4.3258769118e-15 -2.7237002778e-15 ] [ 2.515417315379999e-14 -4.165659248399999e-15 -9.2926244772e-15 ] [ 1.50604603596e-14 2.162938455899999e-14 -2.67563497878e-14 ] [ -4.10157218304e-14 3.076179137279999e-14 -5.22309582684e-14 ] [ -5.2871828922e-15 7.370012516399999e-15 1.602176634e-14 ] [ -2.99607030558e-14 -2.98004853924e-14 4.806529901999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.78446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.689166962630764e-18 } }