{ "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" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -77.9075791 -216.6299393 -338.518379 ] [ -2295.8077264 -2456.92833 1647.5341345 ] [ 2380.9697782 2676.2662375 -1317.7083076 ] [ -206.2933721 -55.3558875 28.1241587 ] [ 1.1126285 -19.8651074 4.2177382 ] [ 197.9262709 72.5130266 -23.6493448 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.248217018171467e-07 -3.470794241117831e-07 -5.423662325449137e-07 ] [ -3.678289465090083e-06 -3.936433129307188e-06 2.639640672265863e-06 ] [ 3.814734113463401e-06 4.28785119675888e-06 -2.111201443470655e-06 ] [ -3.30518417804615e-07 -8.868990877613496e-08 4.505986954880892e-08 ] [ 1.782627370335773e-09 -3.182741064596107e-08 6.757561536695075e-09 ] [ 3.171128438781074e-07 1.161786759219685e-07 -3.789042733579806e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 452.77707 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.254288359883251e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9341673 -0.2862918 0.9446939 ] [ -0.1512215 0.9467398 2.4365958 ] [ 1.9484709 1.4154916 1.9372997 ] [ 0.3193849 1.7837946 0.4477283 ] [ 2.2916602 1.0226598 -0.2163226 ] [ 2.0873993 3.1052883 0.5220209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.341673000000001e-11 -2.862918e-11 9.446939e-11 ] [ -1.512215e-11 9.467398e-11 2.4365958e-10 ] [ 1.9484709e-10 1.4154916e-10 1.9372997e-10 ] [ 3.193849e-11 1.7837946e-10 4.477283e-11 ] [ 2.2916602e-10 1.0226598e-10 -2.163226e-11 ] [ 2.0873993e-10 3.1052883e-10 5.220209e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001458 0.0001273 -0.0001741 ] [ 2.88e-05 6.19e-05 5.49e-05 ] [ 0.0001151 4.41e-05 -0.0001421 ] [ 0.0001608 -0.0002031 -8.6e-06 ] [ -2.86e-05 8.52e-05 0.0002577 ] [ -0.0001302 -0.0001154 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.3359735131264e-13 2.0395708382784e-13 -2.7893894968128e-13 ] [ 4.614268667904e-14 9.917473282752e-14 8.795949648192e-14 ] [ 1.8441052905408e-13 7.065598897728e-14 -2.2766929781568e-13 ] [ 2.5763000062464e-13 -3.254020716844801e-13 -1.377871893888e-14 ] [ -4.582225135488e-14 1.3650544809216e-13 4.1288091518016e-13 ] [ -2.0860339602816e-13 -1.8489118204032e-13 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }