{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -32.6254792 -31.6642019 -29.1770061 ] [ -0.1776101 -16.3818582 28.4017718 ] [ 29.3947735 38.1272547 -18.1144704 ] [ -15.9055908 17.8658135 19.2232812 ] [ 11.9095497 -11.2155252 -6.3968145 ] [ 7.4043569 3.2685171 6.0632379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.227178044729301e-08 -5.073164441843839e-08 -4.674671742349546e-08 ] [ -2.845627521824034e-10 -2.624663042954129e-08 4.550465514216012e-08 ] [ 4.709561926342239e-08 6.108659659890668e-08 -2.902258121216463e-08 ] [ -2.548356592972536e-08 2.862418893710176e-08 3.079909196745147e-08 ] [ 1.908120225080171e-08 -1.796925241347817e-08 -1.024882672393239e-08 ] [ 1.186308761497667e-08 5.236741725449441e-09 9.714378089763228e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 18.829842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.016873287431182e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3854425 0.5596448 0.8413766 ] [ 0.1832289 1.0346135 3.2876246 ] [ 0.9335376 2.939207 1.3779337 ] [ -0.5939303 3.3167913 3.2063699 ] [ 2.60801 -0.3760833 0.7813419 ] [ 2.5240942 1.3472268 2.4671213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.854425e-11 5.596448000000001e-11 8.413766000000001e-11 ] [ 1.832289e-11 1.0346135e-10 3.2876246e-10 ] [ 9.335376e-11 2.939207e-10 1.3779337e-10 ] [ -5.939303e-11 3.3167913e-10 3.2063699e-10 ] [ 2.60801e-10 -3.760833000000001e-11 7.813419000000001e-11 ] [ 2.5240942e-10 1.3472268e-10 2.4671213e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0018959 -0.0021511 -0.0029374 ] [ -0.0010834 0.0010747 0.0014939 ] [ -0.0008016 0.0018468 0.0006876 ] [ -0.0007406 6.17e-05 -0.0002193 ] [ 0.0001054 -0.0004704 -0.0004043 ] [ 0.0044161 -0.0003617 0.0013795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.0375666804006e-12 -3.4464421573974e-12 -4.7062336447116e-12 ] [ -1.7357981652756e-12 1.7218592285598e-12 2.3934916735326e-12 ] [ -1.2843047898144e-12 2.9588998076712e-12 1.1016566535384e-12 ] [ -1.1865720151404e-12 9.885429831779999e-14 -3.513573358362e-13 ] [ 1.688694172236e-13 -7.536638886335999e-13 -6.477600131261999e-13 ] [ 7.075372233407399e-12 -5.795072885178e-13 2.210202666603e-12 ] ] } "relaxed-potential-energy" { "source-value" -14.425405 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.311204682698677e-18 } }