{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9340545 -3.1563314 -5.5732692 ] [ -5.2165527 -17.5935499 7.0801826 ] [ 8.1830716 3.0708202 -5.5505431 ] [ -2.0324644 17.6790611 4.0436297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.496520282453034e-09 -5.057000376576933e-09 -8.92936161366472e-09 ] [ -8.357838777111118e-09 -2.818797432665818e-08 1.134370303271496e-08 ] [ 1.311072600385245e-08 4.91999633112038e-09 -8.892950387562757e-09 ] [ -3.256366944288299e-09 2.832497837211473e-08 6.478608968512518e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.1438027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.832573944747916e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6993709 0.3684608 -0.0401756 ] [ 0.6898884 0.6197232 2.0578502 ] [ 2.5416162 2.5487693 0.103994 ] [ 1.5321609 2.8000213 2.2020355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6993709e-10 3.684608e-11 -4.01756e-12 ] [ 6.898884e-11 6.197232e-11 2.0578502e-10 ] [ 2.5416162e-10 2.5487693e-10 1.03994e-11 ] [ 1.5321609e-10 2.8000213e-10 2.2020355e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-06 1.23e-05 -3.3e-06 ] [ -3e-07 1.3e-06 1.93e-05 ] [ 1.23e-05 2.5e-06 -3.5e-06 ] [ -9.6e-06 -1.62e-05 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.84522388992e-15 1.970677243584e-14 -5.28718284864e-15 ] [ -4.8065298624e-16 2.08282960704e-15 3.092200878144e-14 ] [ 1.970677243584e-14 4.005441552e-15 -5.6076181728e-15 ] [ -1.538089555968e-14 -2.595526125696e-14 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }