{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.4139974 -5.4856893 -17.5399733 ] [ -0.0769957 0.0660871 0.3391216 ] [ -19.1134962 8.8752406 11.2567425 ] [ 16.9334785 -22.3132938 -11.1781325 ] [ -5.7276176 -14.9577088 17.6021364 ] [ 1.1248045 20.705379 -13.3729092 ] [ 19.2738239 13.1099852 12.8930145 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.988941640495198e-08 -8.789043145432717e-09 -2.810213515071623e-08 ] [ -1.233607104421306e-10 1.058832065564717e-10 5.433326991282893e-10 ] [ -3.062319675338964e-08 1.421970299329496e-08 1.803528965986574e-08 ] [ 2.713042336151945e-08 -3.574983765940159e-08 -1.790934255570466e-08 ] [ -9.176655011602607e-09 -2.396489134009442e-08 2.820173141621268e-08 ] [ 1.802135472870634e-09 3.317367415860328e-08 -2.142576247232123e-08 ] [ 3.088007004599628e-08 2.100451178647401e-08 2.06568864035354e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.388876 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.504263762279022e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0692737 1.9848029 0.9070111 ] [ 1.2287997 3.2705109 1.6593332 ] [ 1.8995159 4.0349268 3.7946161 ] [ 4.6294932 2.1277962 2.6786992 ] [ 3.1945332 2.2093592 4.5557487 ] [ 3.577217 5.6419921 3.3515794 ] [ 5.4176885 4.3562649 2.5992863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0692737e-10 1.9848029e-10 9.070111e-11 ] [ 1.2287997e-10 3.2705109e-10 1.6593332e-10 ] [ 1.8995159e-10 4.0349268e-10 3.7946161e-10 ] [ 4.6294932e-10 2.1277962e-10 2.6786992e-10 ] [ 3.1945332e-10 2.2093592e-10 4.5557487e-10 ] [ 3.577217e-10 5.641992100000001e-10 3.3515794e-10 ] [ 5.4176885e-10 4.356264900000001e-10 2.599286300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.98e-05 -7.1e-06 -7.8e-06 ] [ 1.54e-05 7e-07 7.1e-06 ] [ 1.56e-05 -3.38e-05 -2.01e-05 ] [ 9.3e-06 4.89e-05 1.99e-05 ] [ -1.22e-05 2.41e-05 -9.3e-06 ] [ 9.5e-06 -1.43e-05 1.41e-05 ] [ -7.8e-06 -1.85e-05 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.774486329984001e-14 -1.137545400768e-14 -1.249697764224e-14 ] [ 2.467351996032e-14 1.12152363456e-15 1.137545400768e-14 ] [ 2.499395528448e-14 -5.415356978304e-14 -3.220375007808e-14 ] [ 1.490024257344e-14 7.834643675712001e-14 3.188331475392e-14 ] [ -1.954655477376e-14 3.861245656128e-14 -1.490024257344e-14 ] [ 1.52206778976e-14 -2.291112567744e-14 2.259069035328e-14 ] [ -1.249697764224e-14 -2.96402674848e-14 -6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }