{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5218481 -0.6996077 -0.0427555 ] [ -1.00433 3.3700754 -1.5385881 ] [ 1.5555979 -2.7245967 1.2191035 ] [ -0.0294199 0.054129 0.3622401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.360928323172954e-10 -1.120895109906482e-09 -6.850186307498699e-11 ] [ -1.60911405882522e-09 5.399456060698204e-09 -2.465089903170455e-09 ] [ 2.492342607279468e-09 -4.365285169813508e-09 1.953219142127618e-09 ] [ -4.713587635461659e-11 8.672421902178598e-11 5.803726241178234e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.068673546151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.132526358901823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5110475 3.1705567 1.755805 ] [ 1.3660439 5.1329618 0.997135 ] [ 2.5960824 2.489829 2.3447638 ] [ 3.4512882 4.4515476 1.5845557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.110475e-11 3.1705567e-10 1.755805e-10 ] [ 1.3660439e-10 5.1329618e-10 9.97135e-11 ] [ 2.5960824e-10 2.489829e-10 2.3447638e-10 ] [ 3.4512882e-10 4.4515476e-10 1.5845557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.24e-05 6.8e-06 2.59e-05 ] [ -7.7e-06 1.1e-05 -3.66e-05 ] [ 1.32e-05 -3.24e-05 -1.44e-05 ] [ 6.9e-06 1.46e-05 2.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.98669902616e-14 1.08948011112e-14 4.149637482059999e-14 ] [ -1.23367600818e-14 1.7623942974e-14 -5.86396648044e-14 ] [ 2.11487315688e-14 -5.19105229416e-14 -2.30713435296e-14 ] [ 1.10550187746e-14 2.33917788564e-14 4.02146335134e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }