{ "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" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1747461 1.7215022 -0.8339612 ] [ -0.16008 1.0690424 1.5397302 ] [ 1.8750719 0.2664864 2.8674373 ] [ -2.4627806 -1.0370628 0.9336421 ] [ -2.4269573 -2.0199681 -4.5068484 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.086503978395979e-09 2.758150577495765e-09 -1.336153137294313e-09 ] [ -2.56476433457664e-10 1.712794739923922e-09 2.466919728779708e-09 ] [ 3.004196360499036e-09 4.269582798411571e-10 4.594141003669876e-09 ] [ -3.945809499479796e-09 -1.661557772461386e-09 1.495859544814616e-09 ] [ -3.888414245739892e-09 -3.236345664581796e-09 -7.220767139969887e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.530393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.687154947243597e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6596375 1.1003179 2.2082195 ] [ 2.6185148 0.3057423 0.9800468 ] [ 3.0653401 2.660492 0.4979312 ] [ 0.9456488 1.7697115 -0.0375336 ] [ 2.7792768 1.9912072 2.7437136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.596375e-11 1.1003179e-10 2.2082195e-10 ] [ 2.6185148e-10 3.057423e-11 9.800468e-11 ] [ 3.0653401e-10 2.660492e-10 4.979312e-11 ] [ 9.456488e-11 1.7697115e-10 -3.75336e-12 ] [ 2.7792768e-10 1.9912072e-10 2.7437136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 2.15e-05 2.7e-06 ] [ -1.29e-05 2.21e-05 9.3e-06 ] [ -1.59e-05 9.5e-06 1.89e-05 ] [ 2.05e-05 -2.38e-05 1.4e-06 ] [ -2.3e-06 -2.94e-05 -3.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 3.44467973472e-14 4.32587687616e-15 ] [ -2.066807840832e-14 3.540810331968e-14 1.490024257344e-14 ] [ -2.547460827072e-14 1.52206778976e-14 3.028113813312e-14 ] [ 3.28446207264e-14 -3.813180357504e-14 2.24304726912e-15 ] [ -3.68500622784e-15 -4.710399265152e-14 -5.159008718975999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }