{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.194843 2.698336 1.615904 ] [ 2.342296 1.479956 3.870973 ] [ 2.299802 3.774539 3.510423 ] [ 4.310954 2.51113 2.445623 ] [ 3.93016 4.43603 0.8578151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.194843e-10 2.698336e-10 1.615904e-10 ] [ 2.342296e-10 1.479956e-10 3.870973000000001e-10 ] [ 2.299802e-10 3.774539e-10 3.510423e-10 ] [ 4.310954e-10 2.51113e-10 2.445623e-10 ] [ 3.93016e-10 4.43603e-10 8.578151e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1673352 0.046633 -1.9340846 ] [ 0.3384792 0.2289441 -0.3022142 ] [ 0.0962916 0.8617212 1.1617715 ] [ 0.4576659 0.511878 -0.1756224 ] [ -0.7251014 -1.6491763 1.2501497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.681005474857168e-10 7.471430297332199e-11 -3.098745154299236e-09 ] [ 5.423034653350127e-10 3.668088875121594e-10 -4.842005297030027e-10 ] [ 1.542761515704744e-10 1.38062957166244e-09 1.861363151347131e-09 ] [ 7.332616111585805e-10 8.20118971058652e-10 -2.813781056870016e-10 ] [ -1.161740520360688e-09 -2.642271733206574e-09 2.002960638342109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.094987 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.098048219393376e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.622685 2.7819317 1.4932919 ] [ 2.5808002 1.5311552 3.2513823 ] [ 2.5906872 3.9715607 3.3972061 ] [ 4.6210164 2.6822518 2.9584422 ] [ 3.6628663 3.9330917 1.2004156 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.622685e-10 2.7819317e-10 1.4932919e-10 ] [ 2.5808002e-10 1.5311552e-10 3.2513823e-10 ] [ 2.5906872e-10 3.9715607e-10 3.3972061e-10 ] [ 4.621016400000001e-10 2.6822518e-10 2.9584422e-10 ] [ 3.6628663e-10 3.9330917e-10 1.2004156e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 0.0 2.21e-05 ] [ 1.22e-05 -6.4e-06 -1.91e-05 ] [ -1.5e-05 9.2e-06 9.2e-06 ] [ -6.4e-06 3e-07 1.06e-05 ] [ 2.58e-05 -3.1e-06 -2.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.6435914461e-14 0.0 3.54081036114e-14 ] [ 1.95465549348e-14 -1.02539304576e-14 -3.06015737094e-14 ] [ -2.403264951e-14 1.47400250328e-14 1.47400250328e-14 ] [ -1.02539304576e-14 4.806529901999999e-16 1.69830723204e-14 ] [ 4.133615715719999e-14 -4.9667475654e-15 -3.65296272552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }