{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.5613981 -15.8267285 -0.1072686 ] [ -0.5596247 0.7453803 0.0797798 ] [ 32.1631439 -31.4002888 -30.3575385 ] [ 20.7646427 4.834253 42.2231026 ] [ -31.8067637 41.6473839 -11.8380753 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.294299159819199e-08 -2.535721459536186e-08 -1.718632444818924e-10 ] [ -8.966176181492597e-10 1.19423090010391e-09 1.278213314251932e-10 ] [ 5.153103763255963e-08 -5.030880901621189e-08 -4.86381388504554e-08 ] [ 3.326862534729867e-08 7.745327199444402e-09 6.764886840070464e-08 ] [ -5.096005360329938e-08 6.672646535180778e-08 -1.896668763719254e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.948746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.875706145080096e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7648863 -0.8204667 3.1999649 ] [ -0.363574 3.4480689 0.9944912 ] [ 2.9791799 1.15297 0.3642879 ] [ 2.6525632 -0.4853684 1.9381425 ] [ 1.5589332 2.8877237 -0.1270224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.648863000000001e-11 -8.204667000000001e-11 3.1999649e-10 ] [ -3.63574e-11 3.4480689e-10 9.944912000000001e-11 ] [ 2.9791799e-10 1.15297e-10 3.642879e-11 ] [ 2.6525632e-10 -4.853684e-11 1.9381425e-10 ] [ 1.5589332e-10 2.8877237e-10 -1.270224e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 -6.9e-06 1.17e-05 ] [ -7.3e-06 -4e-07 6.8e-06 ] [ -7.4e-06 1.04e-05 -2.3e-06 ] [ 1.09e-05 -7.3e-06 -6e-07 ] [ 1.49e-05 4.2e-06 -1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.77841606374e-14 -1.10550187746e-14 1.87454666178e-14 ] [ -1.16958894282e-14 -6.408706536e-16 1.08948011112e-14 ] [ -1.18561070916e-14 1.66626369936e-14 -3.685006258199999e-15 ] [ 1.74637253106e-14 -1.16958894282e-14 -9.613059803999998e-16 ] [ 2.38724318466e-14 6.729141862799999e-15 -2.4833737827e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }