{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9701436 -0.5767862 -0.9151375 ] [ 2.3707051 1.5233055 -0.7338596 ] [ -0.5169088 0.930457 -0.118181 ] [ 2.0395088 -1.1431198 -2.5688125 ] [ -0.9231616 -0.7338565 4.3359906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.758694636338747e-09 -9.24113364840073e-10 -1.46621190731736e-09 ] [ 3.798288286031326e-09 2.440604458436054e-09 -1.17577269406964e-09 ] [ -8.28179194445783e-10 1.490756452059706e-09 -1.893468352227648e-10 ] [ 3.267653317275863e-09 -1.831479818333572e-09 -4.1156913307188e-09 ] [ -1.479067932740321e-09 -1.175767727322115e-09 6.947022767328564e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.203069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.955147185380924e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0523282 2.410232 1.4234537 ] [ 2.3050177 1.5828891 3.6161722 ] [ 2.6370388 4.4660155 2.4175522 ] [ 4.386813 2.0996487 1.3230438 ] [ 4.1669183 3.0221368 3.4810581 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0523282e-10 2.410232e-10 1.4234537e-10 ] [ 2.3050177e-10 1.5828891e-10 3.6161722e-10 ] [ 2.6370388e-10 4.4660155e-10 2.4175522e-10 ] [ 4.386813e-10 2.0996487e-10 1.3230438e-10 ] [ 4.1669183e-10 3.0221368e-10 3.4810581e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.07e-05 5.2e-06 1.01e-05 ] [ -3e-07 -2.2e-06 3.2e-06 ] [ -2.7e-06 3.3e-06 -2.3e-06 ] [ 2.2e-06 -4e-07 -4e-07 ] [ -9.9e-06 -5.9e-06 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.714328984256e-14 8.33131842816e-15 1.618198387008e-14 ] [ -4.8065298624e-16 -3.52478856576e-15 5.126965186560001e-15 ] [ -4.32587687616e-15 5.28718284864e-15 -3.68500622784e-15 ] [ 3.52478856576e-15 -6.408706483200001e-16 -6.408706483200001e-16 ] [ -1.586154854592e-14 -9.45284206272e-15 -1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.18083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.272019428953927e-18 } }