{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3180384 1.8180356 -0.3070134 ] [ -1.1877905 -0.6100389 -0.9386965 ] [ -1.2566443 1.7874534 1.2350625 ] [ 2.7187394 0.5978465 0.1661623 ] [ -0.4814746 -2.0378924 1.6718894 ] [ 0.5252084 -1.5554041 -1.8274042 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.095536931947456e-10 2.91281415810017e-09 -4.918896958048956e-10 ] [ -1.903050185187177e-09 -9.773900714110626e-10 -1.503957598717581e-09 ] [ -2.013366134709286e-09 2.863816071843855e-09 1.978788279029625e-09 ] [ 4.355900740615179e-09 9.578556930186807e-10 2.662213545116982e-10 ] [ -7.714073539844962e-10 -3.265063585886181e-09 2.67866213131228e-09 ] [ 8.414766264605254e-10 -2.492032105447799e-09 -2.927824310113462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.576411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.335398511178057e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0869858 0.3617711 1.4725477 ] [ -0.041301 2.567292 2.4166915 ] [ 2.0989892 0.4504134 0.1052989 ] [ 2.299202 -0.0672653 2.5332457 ] [ 2.8898421 2.6964384 0.4248049 ] [ 2.350712 2.7287257 2.7903398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.69858e-12 3.617711e-11 1.4725477e-10 ] [ -4.1301e-12 2.567292e-10 2.4166915e-10 ] [ 2.0989892e-10 4.504134e-11 1.052989e-11 ] [ 2.299202e-10 -6.72653e-12 2.533245700000001e-10 ] [ 2.8898421e-10 2.6964384e-10 4.248049e-11 ] [ 2.350712e-10 2.7287257e-10 2.7903398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-05 -5.08e-05 -1.3e-06 ] [ -1.3e-06 -1e-06 -4.36e-05 ] [ -3.25e-05 -9.3e-06 9.5e-06 ] [ -2.95e-05 2.53e-05 -3.36e-05 ] [ -3.23e-05 2.5e-06 8.13e-05 ] [ 7.95e-05 3.33e-05 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.5634826144e-14 -8.13905730072e-14 -2.0828296242e-15 ] [ -2.0828296242e-15 -1.602176634e-15 -6.985490124239999e-14 ] [ -5.207074060499999e-14 -1.49002426962e-14 1.5220678023e-14 ] [ -4.726421070299999e-14 4.053506884019999e-14 -5.383313490239999e-14 ] [ -5.17503052782e-14 4.005441585e-15 1.302569603442e-13 ] [ 1.27373042403e-13 5.33524819122e-14 -1.97067725982e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.331643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.776835344342966e-18 } }