{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3897374 -46.1062248 -6.8831146 ] [ -33.340228 55.292795 -10.874627 ] [ -39.182626 47.6404026 9.304746 ] [ 31.3292302 -53.8965272 4.4219707 ] [ -2.8038929 1.6841109 -4.8241609 ] [ 40.1405781 4.2089904 -21.2554863 ] [ 4.246676 -8.823547 30.1106722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.244281505313779e-10 -7.387031544790915e-08 -1.102796529040714e-08 ] [ -5.341693383374155e-08 8.858882344768713e-08 -1.742307313932044e-08 ] [ -6.277748731875022e-08 7.632833925121955e-08 1.490784650368232e-08 ] [ 5.019496017410131e-08 -8.635175582215128e-08 7.08477807340261e-09 ] [ -4.492331651607112e-09 2.698243110814447e-09 -7.729157808957486e-09 ] [ 6.431229577721649e-08 6.743546016051642e-09 -3.40550432135947e-08 ] [ 6.803925003312461e-09 -1.413688071592998e-08 4.824261503541251e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.40539252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.495104177911964e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.2573982 1.9626985 2.8254178 ] [ 2.4133923 3.8539336 0.8012835 ] [ 2.0623696 4.6856906 3.3207207 ] [ 4.1837461 1.847082 0.8319666 ] [ 4.9269614 1.4386281 3.3703414 ] [ 4.623536 4.0446362 2.4676832 ] [ 3.6158835 3.1929841 4.9084701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2573982e-10 1.9626985e-10 2.8254178e-10 ] [ 2.4133923e-10 3.8539336e-10 8.012835e-11 ] [ 2.0623696e-10 4.6856906e-10 3.3207207e-10 ] [ 4.1837461e-10 1.847082e-10 8.319666e-11 ] [ 4.9269614e-10 1.4386281e-10 3.3703414e-10 ] [ 4.623536e-10 4.0446362e-10 2.4676832e-10 ] [ 3.6158835e-10 3.1929841e-10 4.9084701e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-05 -8e-07 1.82e-05 ] [ -5.58e-05 2.57e-05 1.54e-05 ] [ -2.37e-05 2.92e-05 -5.58e-05 ] [ 4.13e-05 -1.18e-05 -2.66e-05 ] [ 1.97e-05 -1.35e-05 -7e-06 ] [ 2.85e-05 -1.85e-05 1.26e-05 ] [ 6e-06 -1.04e-05 4.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-14 -1.28174129664e-15 2.915961449856e-14 ] [ -8.940145544064e-14 4.117593915456e-14 2.467351996032e-14 ] [ -3.797158591296e-14 4.678355732736e-14 -8.940145544064e-14 ] [ 6.616989443904001e-14 -1.890568412544e-14 -4.261789811328e-14 ] [ 3.156287942976e-14 -2.16293843808e-14 -1.12152363456e-14 ] [ 4.56620336928e-14 -2.96402674848e-14 2.018742542208e-14 ] [ 9.6130597248e-15 -1.666263685632e-14 6.921403001856e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.081683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.018528611291681e-18 } }