{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4554778 -1.5189129 -2.7711184 ] [ -1.7831318 3.8827227 -0.8679902 ] [ 1.4091531 -2.4035068 5.1943973 ] [ -4.4518639 3.1183976 -9.5839012 ] [ -0.7993021 3.1189407 -0.571488 ] [ 0.6093299 0.4711137 2.9809548 ] [ 3.5603369 -6.668755 5.6191457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.331932503253418e-09 -2.433566737411528e-09 -4.439821113948703e-09 ] [ -2.856892081765021e-09 6.220807534989453e-09 -1.390673605523516e-09 ] [ 2.257712151947844e-09 -3.850842402893821e-09 8.322341913206645e-09 ] [ -7.13267225956351e-09 4.99622372907883e-09 -1.535510243869706e-08 ] [ -1.280623137576344e-09 4.997093871201586e-09 -9.156247126677504e-10 ] [ 9.76254120134402e-10 7.54807355878585e-10 4.776016088221541e-09 ] [ 5.704288543351548e-09 -1.06845233508431e-08 9.00286386940885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.436985 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.235671929144029e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6484169 1.9235934 1.2101155 ] [ 0.605211 2.8477178 2.0529166 ] [ 1.8035459 1.4557885 3.4736785 ] [ 2.4718699 4.2288841 2.053222 ] [ 4.0701529 1.18373 3.0312851 ] [ 4.5556688 3.1982931 1.9993716 ] [ 3.2946345 3.2166622 4.0385648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6484169e-10 1.9235934e-10 1.2101155e-10 ] [ 6.05211e-11 2.8477178e-10 2.0529166e-10 ] [ 1.8035459e-10 1.4557885e-10 3.4736785e-10 ] [ 2.4718699e-10 4.2288841e-10 2.053222e-10 ] [ 4.0701529e-10 1.18373e-10 3.0312851e-10 ] [ 4.555668800000001e-10 3.1982931e-10 1.9993716e-10 ] [ 3.2946345e-10 3.2166622e-10 4.0385648e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 3.9e-06 6e-06 ] [ 1e-06 -3.6e-06 1.3e-06 ] [ -2e-07 3.5e-06 -5.6e-06 ] [ 3.2e-06 -1.6e-06 4.8e-06 ] [ 5.1e-06 5.9e-06 -2.7e-06 ] [ -2.9e-06 -1e-05 1.9e-06 ] [ -4.6e-06 1.9e-06 -5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-15 6.24848882112e-15 9.6130597248e-15 ] [ 1.6021766208e-15 -5.76783583488e-15 2.08282960704e-15 ] [ -3.2043532416e-16 5.6076181728e-15 -8.972189076479999e-15 ] [ 5.126965186560001e-15 -2.56348259328e-15 7.69044777984e-15 ] [ 8.17110076608e-15 9.45284206272e-15 -4.32587687616e-15 ] [ -4.646312200320001e-15 -1.6021766208e-14 3.04413557952e-15 ] [ -7.370012455680001e-15 3.04413557952e-15 -9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497168915979e-18 } }