{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4143554 0.2271004 -0.1109008 ] [ 0.0041411 -0.3266314 0.709039 ] [ -1.5875652 -0.0266961 -1.0145584 ] [ 0.894025 1.8267994 0.2819841 ] [ 0.2750438 -1.7005723 0.134436 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.638705400517235e-10 3.638549544520536e-10 -1.776826704519072e-10 ] [ 6.634773659057399e-12 -5.233211970107076e-10 1.136005718394726e-09 ] [ -2.543559868391536e-09 -4.27718676389274e-11 -1.625501762308426e-09 ] [ 1.43238596521185e-09 2.926855313685219e-09 4.517883361795194e-10 ] [ 4.406687496865692e-10 -2.724617203487638e-09 2.15390217968424e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.3066 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.97173469639844e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3279532 1.9182793 1.3070435 ] [ 0.8972657 1.2627002 3.1101559 ] [ 0.6165577 3.4073191 2.0697663 ] [ 2.9253773 3.9123822 2.4879229 ] [ 3.2060839 1.7677641 3.5283224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3279532e-10 1.9182793e-10 1.3070435e-10 ] [ 8.972657000000001e-11 1.2627002e-10 3.1101559e-10 ] [ 6.165577e-11 3.4073191e-10 2.0697663e-10 ] [ 2.9253773e-10 3.9123822e-10 2.4879229e-10 ] [ 3.2060839e-10 1.7677641e-10 3.5283224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.22e-05 -3.6e-06 6.8e-06 ] [ 1.15e-05 1.47e-05 -9.5e-06 ] [ -1.03e-05 -3e-07 -1e-05 ] [ -3e-07 -1.58e-05 1.37e-05 ] [ 1.14e-05 5.1e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.95465549348e-14 -5.767835882399999e-15 1.08948011112e-14 ] [ 1.8425031291e-14 2.35519965198e-14 -1.5220678023e-14 ] [ -1.65024193302e-14 -4.806529901999999e-16 -1.602176634e-14 ] [ -4.806529901999999e-16 -2.53143908172e-14 2.19498198858e-14 ] [ 1.82648136276e-14 8.1711008334e-15 -1.7623942974e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }