{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7030555 -1.1759178 -0.1296072 ] [ -1.3834396 2.5993808 0.4653713 ] [ 0.3452815 -1.4589721 1.1054873 ] [ 0.6822355 -0.5933476 -1.0577882 ] [ 0.9650739 -1.0945241 -1.5654732 ] [ 1.1628097 1.1758249 -0.436263 ] [ -1.0689055 0.5475558 1.618273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.126419085224854e-09 -1.88402800714257e-09 -2.076536257273498e-10 ] [ -2.216514583408903e-09 4.164667146316401e-09 7.45607016851303e-10 ] [ 5.532019468947552e-10 -2.337530989019479e-09 1.771185906651316e-09 ] [ 1.093061767979798e-09 -9.5064765272779e-10 -1.694763523798115e-09 ] [ 1.546218839924277e-09 -1.753620923922161e-09 -2.508164561528963e-09 ] [ 1.863026515779462e-09 1.883879164934498e-09 -6.989703791200704e-10 ] [ -1.712575401944534e-09 8.772811013434407e-10 2.592759166671878e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.941212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.714281379441641e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7575135 0.6154119 1.8335932 ] [ 1.8921366 2.9794333 2.7618405 ] [ 2.3543559 -0.0797523 4.0469771 ] [ 2.3997826 2.1542124 4.8840617 ] [ 5.0733012 1.021747 2.4654505 ] [ 3.8169459 2.7698221 1.4623558 ] [ 4.4383073 0.8924682 4.7152623 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7575135e-10 6.154119e-11 1.8335932e-10 ] [ 1.8921366e-10 2.9794333e-10 2.7618405e-10 ] [ 2.3543559e-10 -7.97523e-12 4.0469771e-10 ] [ 2.3997826e-10 2.1542124e-10 4.884061700000001e-10 ] [ 5.073301200000001e-10 1.021747e-10 2.4654505e-10 ] [ 3.8169459e-10 2.7698221e-10 1.4623558e-10 ] [ 4.4383073e-10 8.924682e-11 4.7152623e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-05 -4.21e-05 1.8e-05 ] [ 4.4e-06 -2.2e-05 1.16e-05 ] [ -1.68e-05 3.96e-05 -4.7e-06 ] [ -2.56e-05 2.35e-05 -3.29e-05 ] [ 3.24e-05 -2.16e-05 -9.5e-05 ] [ -2.01e-05 4.59e-05 3.8e-05 ] [ 5.7e-06 -2.32e-05 6.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-14 -6.745163573568001e-14 2.88391791744e-14 ] [ 7.04957713152e-15 -3.52478856576e-14 1.858524880128e-14 ] [ -2.691656722944e-14 6.344619418368e-14 -7.53023011776e-15 ] [ -4.101572149248001e-14 3.76511505888e-14 -5.271161082432e-14 ] [ 5.191052251392001e-14 -3.460701500928e-14 -1.52206778976e-13 ] [ -3.220375007808e-14 7.353990689472e-14 6.08827115904e-14 ] [ 9.13240673856e-15 -3.717049760256e-14 1.04141480352e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.845416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.500021478685025e-18 } }