{ "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" [ [ -0.8160862 -1.2930484 0.1718331 ] [ -1.1483181 1.2845699 1.3042529 ] [ -0.3212942 -0.1074409 -0.4382464 ] [ 1.1917893 -0.851139 -2.3328816 ] [ 0.5810587 -0.7589957 -1.7846698 ] [ 0.7355582 0.4428808 0.5447911 ] [ -0.2227077 1.2831733 2.5349207 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.30751424096985e-09 -2.071691933111085e-09 2.753069777677854e-10 ] [ -1.839808428219275e-09 2.058107878519716e-09 2.089643521206738e-09 ] [ -5.147700598797227e-10 -1.721392995159306e-10 -7.021481420146175e-10 ] [ 1.909456969111216e-09 -1.363675018086126e-09 -3.737688389408534e-09 ] [ 9.309586721224158e-10 -1.216045175846474e-09 -2.859356252965453e-09 ] [ 1.178494160987099e-09 7.095732694072271e-10 8.728515708311573e-10 ] [ -3.568170731518818e-10 2.055870278632672e-09 4.061390714582923e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.45188006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.635881782537944e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3099235 0.8679873 1.2028652 ] [ 2.1160023 2.5846329 2.9828096 ] [ 2.4621265 0.1264202 3.5497987 ] [ 2.305694 1.7935299 5.4864008 ] [ 4.8802388 0.4734154 2.7974575 ] [ 4.1411962 2.4373184 1.5619163 ] [ 4.5171616 2.0700385 4.5882929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3099235e-10 8.679873e-11 1.2028652e-10 ] [ 2.1160023e-10 2.5846329e-10 2.9828096e-10 ] [ 2.4621265e-10 1.264202e-11 3.5497987e-10 ] [ 2.305694e-10 1.7935299e-10 5.4864008e-10 ] [ 4.880238800000001e-10 4.734154e-11 2.7974575e-10 ] [ 4.141196200000001e-10 2.4373184e-10 1.5619163e-10 ] [ 4.5171616e-10 2.0700385e-10 4.5882929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.13e-05 4.41e-05 1.74e-05 ] [ 7.33e-05 -5.05e-05 5.9e-05 ] [ 2.07e-05 6.85e-05 -5.9e-05 ] [ 4.86e-05 -6.2e-05 -4.55e-05 ] [ -0.0001074 5.19e-05 8.14e-05 ] [ -4.47e-05 -0.0001015 3.44e-05 ] [ -4.18e-05 4.96e-05 -8.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.21916613242e-14 7.06559895594e-14 2.78778734316e-14 ] [ 1.174395472722e-13 -8.090992001699999e-14 9.452842140599998e-14 ] [ 3.316505632379999e-14 1.09749099429e-13 -9.452842140599998e-14 ] [ 7.786578441239999e-14 -9.933495130799999e-14 -7.289903684699999e-14 ] [ -1.720737704916e-13 8.315296730459999e-14 1.304171780076e-13 ] [ -7.16172955398e-14 -1.62620928351e-13 5.51148762096e-14 ] [ -6.697098330119999e-14 7.94679610464e-14 -1.405108908018e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.015040064916388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.886327625258288e-18 } }