{ "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" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.6991969 -17.2057069 -28.1589958 ] [ -3.7061824 18.8359245 -28.9569349 ] [ -13.8043624 -16.2510486 23.8435157 ] [ 6.8966687 -15.8834344 31.936222 ] [ 31.7972344 20.9300853 -8.8885393 ] [ 6.5158385 9.5741802 10.2247322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.437900568811584e-08 -2.756658133951724e-08 -4.511568473596539e-08 ] [ -5.937958793700434e-09 3.017847786505393e-08 -4.639412410680759e-08 ] [ -2.211702670233058e-08 -2.603705013040457e-08 3.820152341221775e-08 ] [ 1.104968135254313e-08 -2.544806725369048e-08 5.116746824507862e-08 ] [ 5.094478556177751e-08 3.353369333900976e-08 -1.4241009859522e-08 ] [ 1.043952410960854e-08 1.533952767976627e-08 1.638182688478095e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4296972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.097157291063222e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3806219 2.5039946 1.680383 ] [ 2.1434946 5.1676367 1.6760638 ] [ 1.7356585 3.7927967 4.0565979 ] [ 3.6928128 2.0217086 3.9922956 ] [ 4.5405995 4.040034 2.5161669 ] [ 3.3491607 5.8815683 3.9860539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3806219e-10 2.5039946e-10 1.680383e-10 ] [ 2.1434946e-10 5.1676367e-10 1.6760638e-10 ] [ 1.7356585e-10 3.7927967e-10 4.0565979e-10 ] [ 3.6928128e-10 2.0217086e-10 3.9922956e-10 ] [ 4.5405995e-10 4.040034000000001e-10 2.5161669e-10 ] [ 3.3491607e-10 5.8815683e-10 3.9860539e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.59e-05 9.5e-06 3e-07 ] [ -1.76e-05 -7.3e-06 1.15e-05 ] [ 1.94e-05 1.47e-05 -1.19e-05 ] [ -5.3e-06 2.04e-05 -1.06e-05 ] [ -1.15e-05 -1.89e-05 1.76e-05 ] [ -8e-07 -1.83e-05 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.547460827072e-14 1.52206778976e-14 4.8065298624e-16 ] [ -2.819830852608e-14 -1.169588933184e-14 1.84250311392e-14 ] [ 3.108222644352e-14 2.355199632576e-14 -1.906590178752e-14 ] [ -8.491536090240001e-15 3.268440306432e-14 -1.698307218048e-14 ] [ -1.84250311392e-14 -3.028113813312e-14 2.819830852608e-14 ] [ -1.28174129664e-15 -2.931983216064e-14 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.832972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.337810068018102e-18 } }