{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4221956 -0.0537429 -0.0472634 ] [ 0.2852977 -0.5172777 0.1658198 ] [ -0.4325058 0.1150487 -0.1908435 ] [ -1.379365 0.7230997 -0.0841149 ] [ 1.1043775 -0.2671277 0.156402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.764319197246285e-10 -8.610561791399234e-11 -7.572431449951873e-11 ] [ 4.570973049080121e-10 -8.287702374011961e-10 2.656726068257318e-10 ] [ -6.929506811204006e-10 1.84328337393433e-10 -3.057649939316448e-10 ] [ -2.209986354549792e-09 1.158533433847494e-09 -1.347669262409299e-10 ] [ 1.769407811037552e-09 -4.279857557080762e-10 2.505836278463616e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.61171 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.501271677270957e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1261029 2.5487599 1.597672 ] [ 1.9566306 1.821978 3.9425349 ] [ 1.7036424 4.8265344 2.4274844 ] [ 0.1709235 3.0869944 2.9915485 ] [ 3.4893482 3.5615163 3.3784653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1261029e-10 2.5487599e-10 1.597672e-10 ] [ 1.9566306e-10 1.821978e-10 3.9425349e-10 ] [ 1.7036424e-10 4.8265344e-10 2.4274844e-10 ] [ 1.709235e-11 3.0869944e-10 2.9915485e-10 ] [ 3.4893482e-10 3.5615163e-10 3.3784653e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 3.9e-06 2.6e-06 ] [ -2e-07 1.63e-05 -4.7e-06 ] [ -1.13e-05 -1.18e-05 5.2e-06 ] [ 2.92e-05 9.3e-06 4.9e-06 ] [ -2.95e-05 -1.76e-05 -8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 6.24848882112e-15 4.16565921408e-15 ] [ -3.2043532416e-16 2.611547891904e-14 -7.53023011776e-15 ] [ -1.810459581504e-14 -1.890568412544e-14 8.33131842816e-15 ] [ 4.678355732736e-14 1.490024257344e-14 7.850665441919999e-15 ] [ -4.72642103136e-14 -2.819830852608e-14 -1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }