{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.781715 -1.7294122 -1.923375 ] [ 3.5986831 2.2394508 1.0840773 ] [ -3.0743566 -1.6606077 0.5203556 ] [ -1.1335071 -4.5022952 -0.8471042 ] [ 1.7885174 1.9713761 -1.5815501 ] [ 0.6023782 3.6814882 2.7475964 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.854622117928672e-09 -2.770823794566294e-09 -3.0815864580312e-09 ] [ 5.765725928488069e-09 3.587995715191857e-09 1.736883305199988e-09 ] [ -4.925662268522177e-09 -2.66058683326046e-09 8.337015768223566e-10 ] [ -1.816078575130808e-09 -7.21347210938006e-09 -1.357210544621487e-09 ] [ 2.865520764174002e-09 3.158492698223883e-09 -2.533922594843902e-09 ] [ 9.651162689195865e-10 5.898394323791074e-09 4.402134715474245e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.915259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.671429222937679e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4453557 2.2468554 5.2270734 ] [ 1.5347905 1.6238523 3.1655957 ] [ 1.6681758 3.9811329 3.6459462 ] [ 3.9005805 2.0748406 3.2359979 ] [ 3.7067755 4.3299064 2.4099174 ] [ 3.8919897 4.0492213 4.7237595 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4453557e-10 2.2468554e-10 5.2270734e-10 ] [ 1.5347905e-10 1.6238523e-10 3.1655957e-10 ] [ 1.6681758e-10 3.9811329e-10 3.6459462e-10 ] [ 3.9005805e-10 2.0748406e-10 3.2359979e-10 ] [ 3.7067755e-10 4.3299064e-10 2.4099174e-10 ] [ 3.8919897e-10 4.0492213e-10 4.7237595e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 1.66e-05 4.12e-05 ] [ -4.7e-06 -1.25e-05 -8.1e-06 ] [ 3.2e-06 -2.04e-05 -1.48e-05 ] [ -1.15e-05 -5e-07 -2.52e-05 ] [ 9.8e-06 2.58e-05 -1.89e-05 ] [ 8.4e-06 -9e-06 2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 2.659613190528e-14 6.600967677696001e-14 ] [ -7.53023011776e-15 -2.002720776e-14 -1.297763062848e-14 ] [ 5.126965186560001e-15 -3.268440306432e-14 -2.371221398784e-14 ] [ -1.84250311392e-14 -8.010883104e-16 -4.037485084416e-14 ] [ 1.570133088384e-14 4.133615681664e-14 -3.028113813312e-14 ] [ 1.345828361472e-14 -1.44195895872e-14 4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }