{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3078428 -1.3649736 7.7242638 ] [ -3.362897 0.682345 2.7605377 ] [ 7.6031798 -22.3272975 5.1688426 ] [ 48.7297465 16.2981057 10.7924899 ] [ -45.6621864 6.7118205 -26.4461339 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.170845488264161e-08 -2.186928789929211e-09 1.237563487325177e-08 ] [ -5.387954951558458e-09 1.093237206319776e-09 4.422868963777005e-09 ] [ 1.218163691929882e-08 -3.577227406014629e-08 8.281398770315086e-09 ] [ 7.807366057981062e-08 2.611244391586722e-08 1.729147499800013e-08 ] [ -7.315888750469172e-08 1.075352188810617e-08 -4.237137744512632e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.999298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.40315245840122e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5283343 0.7237224 3.126304 ] [ 0.3851933 2.4698471 1.9410308 ] [ 2.4641225 -0.0651089 1.0616876 ] [ 2.75459 2.2186443 1.7158623 ] [ 1.3209829 1.6810169 -0.1235854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5283343e-10 7.237224e-11 3.126304e-10 ] [ 3.851933e-11 2.4698471e-10 1.9410308e-10 ] [ 2.4641225e-10 -6.51089e-12 1.0616876e-10 ] [ 2.75459e-10 2.2186443e-10 1.7158623e-10 ] [ 1.3209829e-10 1.6810169e-10 -1.235854e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.4e-06 -7.4e-06 1.42e-05 ] [ -9.4e-06 6.5e-06 2.4e-06 ] [ 4.6e-06 -1.08e-05 -3.6e-06 ] [ 1.34e-05 1.04e-05 2.2e-06 ] [ -5.2e-06 1.2e-06 -1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.44740051072e-15 -1.185610699392e-14 2.275090801536e-14 ] [ -1.506046023552e-14 1.04141480352e-14 3.84522388992e-15 ] [ 7.370012455680001e-15 -1.730350750464e-14 -5.76783583488e-15 ] [ 2.146916671872e-14 1.666263685632e-14 3.52478856576e-15 ] [ -8.33131842816e-15 1.92261194496e-15 -2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }