{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5590532 0.1863642 -1.2752736 ] [ -6.186428 -5.6820493 11.918002 ] [ -6.5646732 -3.6774736 -3.5240257 ] [ 1.8816262 -2.4020019 -5.0063683 ] [ 11.5441372 -4.7014271 -2.0147952 ] [ 1.2786404 10.7507768 4.6088078 ] [ 6.6057505 5.5258109 -4.706347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.371311504620293e-08 2.985883666541028e-10 -2.043213563877062e-09 ] [ -9.91175038952335e-09 -9.103646621696056e-09 1.909474432836526e-08 ] [ -1.051776601088601e-08 -5.891962274071861e-09 -5.646111634155493e-09 ] [ 3.01469753156221e-09 -3.848431319003605e-09 -8.021086311458302e-09 ] [ 1.849574688153018e-08 -7.53251664607438e-09 -3.228057791735357e-09 ] [ 2.048607772168413e-09 1.722464338630929e-08 7.384124167756945e-09 ] [ 1.058357910113382e-08 8.85332510788251e-09 -7.540399194895998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.822681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.496378958943575e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9205256 2.532122 2.9572858 ] [ 2.4593502 0.9333981 5.6655284 ] [ 2.0920245 0.0837947 3.3511919 ] [ 3.6680643 1.1700846 1.7050016 ] [ 4.4498311 0.7611073 4.028882 ] [ 3.5869042 2.9892029 4.7637682 ] [ 4.250407 3.4936929 2.3939351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9205256e-10 2.532122e-10 2.9572858e-10 ] [ 2.4593502e-10 9.333981e-11 5.6655284e-10 ] [ 2.0920245e-10 8.37947e-12 3.3511919e-10 ] [ 3.6680643e-10 1.1700846e-10 1.7050016e-10 ] [ 4.4498311e-10 7.611073e-11 4.028882e-10 ] [ 3.5869042e-10 2.9892029e-10 4.763768200000001e-10 ] [ 4.250407e-10 3.4936929e-10 2.3939351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.68e-05 -1.86e-05 4.45e-05 ] [ 1.86e-05 2.56e-05 -7.6e-05 ] [ -8.6e-05 2.51e-05 8.76e-05 ] [ 5.96e-05 7.68e-05 -0.0001372 ] [ 7.1e-05 -6.57e-05 0.0001015 ] [ -6.23e-05 -2.16e-05 1.72e-05 ] [ -4.77e-05 -2.16e-05 -3.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.498186647119999e-14 -2.98004853924e-14 7.129686021299999e-14 ] [ 2.98004853924e-14 4.10157218304e-14 -1.21765424184e-13 ] [ -1.37787190524e-13 4.02146335134e-14 1.403506731384e-13 ] [ 9.54897273864e-14 1.230471654912e-13 -2.198186341848e-13 ] [ 1.13754541014e-13 -1.052630048538e-13 1.62620928351e-13 ] [ -9.981560429819998e-14 -3.46070152944e-14 2.75574381048e-14 ] [ -7.64238254418e-14 -3.46070152944e-14 -6.024184143839999e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.335586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.219426053189752e-18 } }