{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9597072 -0.9313295 -1.2461422 ] [ -5.419042 1.8735502 -0.9222109 ] [ -2.0384564 -2.0479488 1.3191174 ] [ -2.8656037 0.9124614 2.0011746 ] [ 4.0623905 -1.1753503 0.1539549 ] [ 3.8788986 0.6345804 -1.4525731 ] [ 1.4221058 0.7340365 0.1466793 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.53762043865343e-09 -1.492154351161354e-09 -1.996539899032278e-09 ] [ -8.682262399533274e-09 3.001758328335164e-09 -1.477544743426927e-09 ] [ -3.265967186600133e-09 -3.281175687955415e-09 2.113459058370482e-09 ] [ -4.591203252617977e-09 1.461924322462437e-09 3.206235158258792e-09 ] [ 6.508667083660023e-09 -1.883118771910266e-09 2.466629414376019e-10 ] [ 6.214680651373852e-09 1.016709880897912e-09 -2.32727866082298e-09 ] [ 2.278464665064081e-09 1.176056119113859e-09 2.350061452153095e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.247978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.244083697007274e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1176305 2.674093 1.060329 ] [ 1.7821069 4.9231015 1.8586922 ] [ 2.2294393 3.0146554 3.4434989 ] [ 4.4346343 3.1008384 0.9202217 ] [ 4.6288757 2.8812505 3.2620768 ] [ 4.035048 5.4146888 1.1582675 ] [ 3.6738342 5.0791514 3.5172779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1176305e-10 2.674093e-10 1.060329e-10 ] [ 1.7821069e-10 4.9231015e-10 1.8586922e-10 ] [ 2.2294393e-10 3.0146554e-10 3.4434989e-10 ] [ 4.4346343e-10 3.1008384e-10 9.202217000000001e-11 ] [ 4.6288757e-10 2.8812505e-10 3.2620768e-10 ] [ 4.035048e-10 5.414688800000001e-10 1.1582675e-10 ] [ 3.6738342e-10 5.0791514e-10 3.5172779e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.57e-05 1.11e-05 -1.56e-05 ] [ 1.03e-05 -9.1e-06 3.6e-05 ] [ 6.8e-06 3.08e-05 1.74e-05 ] [ -1.21e-05 -9.5e-06 -1.99e-05 ] [ -2.28e-05 1.12e-05 -1.59e-05 ] [ 3.4e-06 -2.61e-05 -4.1e-06 ] [ -3.13e-05 -8.4e-06 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.321947157056e-14 1.778416049088e-14 -2.499395528448e-14 ] [ 1.650241919424e-14 -1.457980724928e-14 5.76783583488e-14 ] [ 1.089480102144e-14 4.934703992064001e-14 2.787787320192e-14 ] [ -1.938633711168e-14 -1.52206778976e-14 -3.188331475392e-14 ] [ -3.652962695424e-14 1.794437815296e-14 -2.547460827072e-14 ] [ 5.44740051072e-15 -4.181680980288e-14 -6.568924145279999e-15 ] [ -5.014812823104e-14 -1.345828361472e-14 3.2043532416e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.450209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.596919999187375e-18 } }