{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1114723 -2.3886279 4.6374354 ] [ -1.6242375 4.8844309 -3.1450491 ] [ -1.5635413 -4.125107 -0.3155425 ] [ 3.6729421 2.5894988 -0.8297839 ] [ 2.6263091 -0.9601948 -0.3470599 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.985128175326804e-09 -3.8270037771706e-09 7.429990578350297e-09 ] [ -2.60231534912664e-09 7.825720993893103e-09 -5.038924139288081e-09 ] [ -2.505069316515239e-09 -6.609149993698425e-09 -5.055548163687841e-10 ] [ 5.884701962172057e-09 4.148834436949655e-09 -1.329460364896245e-09 ] [ 4.207811039014289e-09 -1.538401659973732e-09 -5.56051257797186e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0175389 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.124333676113455e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0955507 1.0178998 2.2037492 ] [ 0.9593237 3.0160892 2.7437997 ] [ 1.3592122 -0.2298984 0.8907925 ] [ 3.3131759 0.9971073 0.6193859 ] [ 3.0660183 3.0032481 1.7645899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.555070000000001e-12 1.0178998e-10 2.2037492e-10 ] [ 9.593237000000001e-11 3.0160892e-10 2.7437997e-10 ] [ 1.3592122e-10 -2.298984e-11 8.907925e-11 ] [ 3.3131759e-10 9.971073e-11 6.193859000000001e-11 ] [ 3.0660183e-10 3.0032481e-10 1.7645899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.23e-05 -1.85e-05 -1.75e-05 ] [ 6.7e-06 -2e-07 -1.77e-05 ] [ -1.52e-05 1.69e-05 1.9e-05 ] [ -2.42e-05 1.42e-05 6.2e-06 ] [ 3e-07 -1.25e-05 1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.175030485184e-14 -2.96402674848e-14 -2.8038090864e-14 ] [ 1.073458335936e-14 -3.2043532416e-16 -2.835852618816e-14 ] [ -2.435308463616e-14 2.707678489152e-14 3.04413557952e-14 ] [ -3.877267422336e-14 2.275090801536e-14 9.93349504896e-15 ] [ 4.8065298624e-16 -2.002720776e-14 1.6021766208e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360461099259e-18 } }