{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7149539 0.37674 -0.3586504 ] [ -1.050549 0.426469 -1.0426429 ] [ -3.687981 1.4064725 1.1996564 ] [ -0.7124496 -3.1125796 -2.4213281 ] [ 2.4439366 -3.8012917 4.2784688 ] [ 1.6325891 3.6169749 1.7870322 ] [ 2.0894078 1.0872148 -3.4425359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.145482423529781e-09 6.03604020120192e-10 -5.746212859205683e-10 ] [ -1.683165046804819e-09 6.832786612959552e-10 -1.670498078223112e-09 ] [ -5.908796936154605e-09 2.253417357298128e-09 1.922061437073093e-09 ] [ -1.141470092618312e-09 -4.986902265499016e-09 -3.879395273106085e-09 ] [ 3.915618083237441e-09 -6.090340690581088e-09 6.854862684182231e-09 ] [ 2.615696087392913e-09 5.795032622800418e-09 2.86314121145679e-09 ] [ 3.347600328477162e-09 1.741910134347748e-09 -5.515550535244687e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.540208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.329598131916913e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2990167 1.7348959 2.2203957 ] [ 1.7697709 4.0802451 1.4740186 ] [ 2.1785353 3.4483753 3.9528065 ] [ 3.6573024 1.210381 1.9664607 ] [ 4.1616212 1.8111955 4.26554 ] [ 4.1176315 3.50381 1.2365832 ] [ 4.6323601 4.156539 3.5191474 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2990167e-10 1.7348959e-10 2.2203957e-10 ] [ 1.7697709e-10 4.0802451e-10 1.4740186e-10 ] [ 2.1785353e-10 3.4483753e-10 3.9528065e-10 ] [ 3.6573024e-10 1.210381e-10 1.9664607e-10 ] [ 4.1616212e-10 1.8111955e-10 4.26554e-10 ] [ 4.1176315e-10 3.50381e-10 1.2365832e-10 ] [ 4.6323601e-10 4.156539000000001e-10 3.5191474e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.28e-05 1.41e-05 1.18e-05 ] [ -3.2e-06 -3.2e-06 -2.97e-05 ] [ 1.15e-05 -2.8e-06 2.84e-05 ] [ -9.8e-06 1.63e-05 -3.77e-05 ] [ -7.6e-06 -1e-06 1.98e-05 ] [ -9.4e-06 -2.31e-05 6.9e-06 ] [ -1.44e-05 -3e-07 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.255139316223999e-14 2.259069035328e-14 1.890568412544e-14 ] [ -5.126965186560001e-15 -5.126965186560001e-15 -4.758464563776e-14 ] [ 1.84250311392e-14 -4.48609453824e-15 4.550181603071999e-14 ] [ -1.570133088384e-14 2.611547891904e-14 -6.040205860416e-14 ] [ -1.217654231808e-14 -1.6021766208e-15 3.172309709184e-14 ] [ -1.506046023552e-14 -3.701027994048e-14 1.105501868352e-14 ] [ -2.307134333952e-14 -4.8065298624e-16 6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586648724181e-18 } }