{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.134511 -11.9539333 -2.5355028 ] [ -2.8688434 6.2710087 -4.1521177 ] [ -2.2958591 0.4551871 6.9583502 ] [ 0.9417617 1.010903 1.868616 ] [ 18.3574519 4.2168345 -2.1393457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.264598325721597e-08 -1.915231261765451e-08 -4.062323341601575e-09 ] [ -4.596393862085115e-09 1.004726361075072e-08 -6.652425960557821e-09 ] [ -3.678371804976269e-09 7.292901357182213e-10 1.114850610162923e-08 ] [ 1.508868590536118e-09 1.619645165840502e-09 2.993852893118544e-09 ] [ 2.94118804939589e-08 6.756113705345072e-09 -3.427609692588373e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3817806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.6225631266345e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.560188 0.5067581 -0.545846 ] [ 0.355482 2.6440015 0.7196835 ] [ 0.6437566 2.9443051 3.0625598 ] [ 2.6368798 1.6884454 3.0956369 ] [ 2.5459676 1.2637844 0.7560286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.60188e-11 5.067581e-11 -5.458460000000001e-11 ] [ 3.55482e-11 2.6440015e-10 7.196835e-11 ] [ 6.437566e-11 2.9443051e-10 3.0625598e-10 ] [ 2.6368798e-10 1.6884454e-10 3.0956369e-10 ] [ 2.5459676e-10 1.2637844e-10 7.560286000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.09e-05 1.09e-05 6e-07 ] [ 8.3e-06 -1.85e-05 1.6e-06 ] [ 9.2e-06 5.7e-06 2.09e-05 ] [ -2.27e-05 1.2e-05 -2.14e-05 ] [ -5.8e-06 -1.01e-05 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.74637253106e-14 1.74637253106e-14 9.613059803999998e-16 ] [ 1.32980660622e-14 -2.9640267729e-14 2.5634826144e-15 ] [ 1.47400250328e-14 9.1324068138e-15 3.34854916506e-14 ] [ -3.636940959179999e-14 1.9226119608e-14 -3.42865799676e-14 ] [ -9.2926244772e-15 -1.61819840034e-14 -2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.164352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.788726390815117e-18 } }