{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.6814275 -3.4715525 31.9221362 ] [ 0.1224795 -0.3416035 -0.1380271 ] [ 24.9886039 -4.7975178 -29.8327443 ] [ 0.8281273 0.7076285 -1.908231 ] [ 3.7422168 7.9030453 -0.0431338 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.755488960426503e-08 -5.562040299204285e-09 5.114490072700555e-08 ] [ 1.96233793044003e-10 -5.47309145792619e-10 -2.211437944787814e-10 ] [ 4.003615728486127e-08 -7.686470920359083e-09 -4.779732584555669e-08 ] [ 1.326806210037508e-09 1.133745848252469e-09 -3.057323120474454e-09 ] [ 5.99569231632225e-09 1.266207451710352e-08 -6.91079664956292e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2739415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.485849237638291e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5534311 0.3479378 1.7054059 ] [ 0.0523515 2.3540044 2.7947235 ] [ 2.1501425 0.3810817 0.0046706 ] [ 2.816284 0.432943 2.2764638 ] [ 1.8355292 2.3060402 1.2847638 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.534311e-11 3.479378e-11 1.7054059e-10 ] [ 5.23515e-12 2.3540044e-10 2.7947235e-10 ] [ 2.1501425e-10 3.810817e-11 4.670599999999999e-13 ] [ 2.816284e-10 4.32943e-11 2.2764638e-10 ] [ 1.8355292e-10 2.3060402e-10 1.2847638e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 9.3e-06 -2.6e-06 ] [ 9.3e-06 -1e-07 -5.6e-06 ] [ -3e-07 -3.9e-06 -1.24e-05 ] [ -8e-07 9.4e-06 5.7e-06 ] [ -1.14e-05 -1.46e-05 1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.2871828922e-15 1.49002426962e-14 -4.165659248399999e-15 ] [ 1.49002426962e-14 -1.602176634e-16 -8.972189150399999e-15 ] [ -4.806529901999999e-16 -6.248488872599999e-15 -1.98669902616e-14 ] [ -1.2817413072e-15 1.50604603596e-14 9.1324068138e-15 ] [ -1.82648136276e-14 -2.33917788564e-14 2.38724318466e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.979559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.04086059534244e-18 } }