{ "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" [ [ 1.127389 1.171603 0.6946463 ] [ 1.009133 1.283908 2.574652 ] [ 0.7652821 2.93985 0.2651139 ] [ 0.0212665 2.421916 2.924129 ] [ 2.909562 0.955426 0.4927479 ] [ 2.967895 0.4293313 2.317144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.127389e-10 1.171603e-10 6.946463000000001e-11 ] [ 1.009133e-10 1.283908e-10 2.574652e-10 ] [ 7.652821e-11 2.93985e-10 2.651139e-11 ] [ 2.12665e-12 2.421916e-10 2.924129e-10 ] [ 2.909562e-10 9.55426e-11 4.927479e-11 ] [ 2.967895e-10 4.293313e-11 2.317144e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 943.2558947 -1699.8479625 -1633.0085669 ] [ 816.5226595 -1352.7181053 357.5543529 ] [ -1124.3875763 534.3963488 2443.3548615 ] [ -722.7887383 2519.7124762 -1179.9872465 ] [ 78.3828258 6.0333214 -85.1525765 ] [ 9.0149347 -7.5760786 97.2391755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.511262554371104e-06 -2.723456686870008e-06 -2.616368169009005e-06 ] [ 1.308213526182438e-06 -2.167293340700411e-06 5.728652296013701e-07 ] [ -1.801467502307752e-06 8.56197343342274e-07 3.914686067665606e-06 ] [ -1.158035227822601e-06 4.03702445376592e-06 -1.890547994760298e-06 ] [ 1.255831320036523e-07 9.666446572492167e-09 -1.364294683931975e-07 ] [ 1.44435177333758e-08 -1.213821611026743e-08 1.557943348955253e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 538.34259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.62519918785042e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8108576 0.8115962 0.0998353 ] [ 0.7361 0.5272249 2.7664342 ] [ 0.0667909 3.538456 0.2718662 ] [ -0.0134453 3.2334406 3.1319309 ] [ 3.6401997 0.6981279 0.0691456 ] [ 3.5600247 0.3931885 2.929221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.108576e-11 8.115962000000001e-11 9.983530000000001e-12 ] [ 7.361e-11 5.272249e-11 2.7664342e-10 ] [ 6.67909e-12 3.538456e-10 2.718662e-11 ] [ -1.34453e-12 3.2334406e-10 3.1319309e-10 ] [ 3.6401997e-10 6.981279000000001e-11 6.914560000000001e-12 ] [ 3.5600247e-10 3.931885e-11 2.929221e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.09e-05 9e-07 2.1e-06 ] [ 1.5e-05 2.35e-05 1.29e-05 ] [ -1.74e-05 1.8e-06 2.3e-06 ] [ 4.7e-06 -1.2e-05 -1.09e-05 ] [ 8.5e-06 1.2e-06 1.26e-05 ] [ -2.17e-05 -1.54e-05 -1.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.74637253106e-14 1.4419589706e-15 3.364570931399999e-15 ] [ 2.403264951e-14 3.765115089899999e-14 2.06680785786e-14 ] [ -2.78778734316e-14 2.8839179412e-15 3.685006258199999e-15 ] [ 7.530230179799999e-15 -1.9226119608e-14 -1.74637253106e-14 ] [ 1.3618501389e-14 1.9226119608e-15 2.01874255884e-14 ] [ -3.476723295779999e-14 -2.46735201636e-14 -3.0441356046e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.216451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.437944224460593e-18 } }