{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.2297274 -3.2824013 -4.5336818 ] [ 2.0850641 -13.637028 -11.7287125 ] [ -0.8638528 -10.5239749 15.9639986 ] [ -27.5908788 18.7872372 7.5706918 ] [ 20.8802861 -7.4340512 -26.5805209 ] [ 3.7445731 22.9523672 -4.3811129 ] [ 19.9745358 -6.8621489 23.6893378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.920724304383717e-08 -5.258986622943528e-09 -7.263758986106462e-09 ] [ 3.340640953889393e-09 -2.184892743879499e-08 -1.879146895958472e-08 ] [ -1.384044759972618e-09 -1.686126654266602e-08 2.557714533140393e-08 ] [ -4.420546096068636e-08 3.010047221126406e-08 1.212958540524227e-08 ] [ 3.345390622503521e-08 -1.191066303047018e-08 -4.258668915466577e-08 ] [ 5.999467475696581e-09 3.677374611985676e-08 -7.019316661465288e-09 ] [ 3.200273427009263e-08 -1.099437453602844e-08 3.795450318539371e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.846262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.218415726187145e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9636848 2.8957224 2.8575252 ] [ 2.5463555 2.379063 1.1790435 ] [ 2.1972323 2.4252937 4.8198449 ] [ 0.9135904 5.257241 2.7377579 ] [ 4.2595422 3.7741436 2.0203607 ] [ 3.1355564 5.8494423 2.1733628 ] [ 4.4191992 3.017484 4.255447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.636848e-11 2.8957224e-10 2.8575252e-10 ] [ 2.5463555e-10 2.379063e-10 1.1790435e-10 ] [ 2.1972323e-10 2.4252937e-10 4.8198449e-10 ] [ 9.135904000000001e-11 5.257241e-10 2.7377579e-10 ] [ 4.2595422e-10 3.7741436e-10 2.0203607e-10 ] [ 3.1355564e-10 5.8494423e-10 2.1733628e-10 ] [ 4.419199200000001e-10 3.017484e-10 4.255447e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 -1.09e-05 3.05e-05 ] [ -1.22e-05 3e-06 2.28e-05 ] [ -1.56e-05 1.13e-05 -6.14e-05 ] [ 3.04e-05 -2.16e-05 -6.7e-06 ] [ 6e-06 -2.49e-05 1.3e-05 ] [ -6.6e-06 1.22e-05 2.2e-05 ] [ -3e-06 3.09e-05 -2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-15 -1.746372516672e-14 4.88663869344e-14 ] [ -1.954655477376e-14 4.8065298624e-15 3.652962695424e-14 ] [ -2.499395528448e-14 1.810459581504e-14 -9.837364451712e-14 ] [ 4.870616927232e-14 -3.460701500928e-14 -1.073458335936e-14 ] [ 9.6130597248e-15 -3.989419785791999e-14 2.08282960704e-14 ] [ -1.057436569728e-14 1.954655477376e-14 3.52478856576e-14 ] [ -4.8065298624e-15 4.950725758272e-14 -3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }