{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.5423393 -16.135117 -45.3134079 ] [ -71.4052602 -20.7672566 31.951416 ] [ -11.6508451 11.1216933 -6.8430643 ] [ 484.5580928 2472.6701047 2861.4281134 ] [ -417.3716775 -2493.3951149 -2824.7404446 ] [ 12.3273507 46.5056904 -16.4826126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.675453256159916e-09 -2.585130744425618e-08 -7.2600083344291e-08 ] [ -1.144038394371302e-07 -3.327281327680228e-08 5.119181213841374e-08 ] [ -1.866671178557339e-08 1.781891713577435e-08 -1.096379772641957e-08 ] [ 7.763476540997636e-07 3.961654265340673e-06 4.584513263160181e-06 ] [ -6.687031493838834e-07 -3.994859392422525e-06 -4.525733137452891e-06 ] [ 1.975059325066354e-08 7.45103305069181e-08 -2.640805677499398e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -130.9799240556426 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.098529738450451e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.3553607 0.1532568 0.3037578 ] [ 0.3770888 0.5643596 2.5336745 ] [ 0.4103655 2.868423 0.4033159 ] [ 2.564006 0.4906143 2.0179501 ] [ 1.9919061 1.197347 2.5398113 ] [ 2.0031563 2.5682058 1.4515101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.553607e-11 1.532568e-11 3.037578e-11 ] [ 3.770888e-11 5.643596e-11 2.5336745e-10 ] [ 4.103655e-11 2.868423e-10 4.033159e-11 ] [ 2.564006e-10 4.906143e-11 2.0179501e-10 ] [ 1.9919061e-10 1.197347e-10 2.539811300000001e-10 ] [ 2.0031563e-10 2.5682058e-10 1.4515101e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -37.9771318 35.8863191 11.3302818 ] [ 63.5947228 20.2098715 11.7011185 ] [ 83.0344376 -69.2736577 -20.4430166 ] [ -278.9242621 408.3166361 264.9708712 ] [ 249.3478667 -447.5959684 -295.3693084 ] [ -79.0756331 52.4567994 27.8100535 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.084607319629836e-08 5.749622194228791e-08 1.815311275659546e-08 ] [ 1.01889978915867e-07 3.237978389344253e-08 1.874725865236513e-08 ] [ 1.33035835740051e-07 -1.109886357186542e-07 -3.275332352499412e-08 ] [ -4.468859353923118e-07 6.541953736329008e-07 4.245301385272634e-07 ] [ 3.994993257644867e-07 -7.171278020430824e-07 -4.732338043192199e-07 ] [ -1.26693131671577e-07 8.404505829310521e-08 4.455661790798991e-08 ] ] } "relaxed-potential-energy" { "source-value" -3662.7187540556424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.868322404661543e-16 } }