{ "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" [ [ 0.7351938 0.5081569 -0.1520815 ] [ 0.8761978 0.0366072 -0.0972691 ] [ -1.5872344 0.3709435 0.2123626 ] [ -0.8648838 -0.96009 -1.0350035 ] [ 0.9193697 -1.0549765 1.8683908 ] [ -0.4674904 1.2772095 0.9881066 ] [ 0.3888473 -0.1778506 -1.7845059 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.177910327821669e-09 8.141571115858746e-10 -2.43661425763671e-10 ] [ 1.403823641922205e-09 5.86512004761648e-11 -1.558422792302094e-10 ] [ -2.543029868361009e-09 5.943170082341789e-10 3.402423956554884e-10 ] [ -1.385696615485129e-09 -1.53823376453706e-09 -1.658258423808219e-09 ] [ 1.47299265134759e-09 -1.690258697719101e-09 2.993492082940567e-09 ] [ -7.490021954993135e-10 2.046315217622823e-09 1.583121306421184e-09 ] [ 6.230020582539881e-10 -2.849480756628804e-10 -2.85909365621514e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.633519005765542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985418876023246e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.441538 1.5838071 2.8882895 ] [ 2.0643603 4.0706782 1.3255233 ] [ 2.0033204 3.6965202 3.5675516 ] [ 3.4804127 1.4359251 1.8579217 ] [ 4.2329843 1.6764816 3.9900955 ] [ 4.2942993 3.5418792 1.369919 ] [ 4.299323 3.9401506 3.6356513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.441538e-10 1.5838071e-10 2.8882895e-10 ] [ 2.0643603e-10 4.0706782e-10 1.3255233e-10 ] [ 2.0033204e-10 3.6965202e-10 3.5675516e-10 ] [ 3.4804127e-10 1.4359251e-10 1.8579217e-10 ] [ 4.2329843e-10 1.6764816e-10 3.9900955e-10 ] [ 4.2942993e-10 3.5418792e-10 1.369919e-10 ] [ 4.299323e-10 3.9401506e-10 3.6356513e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 1.04e-05 6.5e-06 ] [ 1.87e-05 -1.45e-05 1.64e-05 ] [ 1.37e-05 -1.66e-05 -3.8e-05 ] [ -2.21e-05 2.53e-05 1.73e-05 ] [ 1.1e-05 -7.6e-06 1.9e-06 ] [ -1.01e-05 1.26e-05 -5e-06 ] [ -1.67e-05 -9.6e-06 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189150399999e-15 1.66626369936e-14 1.0414148121e-14 ] [ 2.99607030558e-14 -2.3231561193e-14 2.62756967976e-14 ] [ 2.19498198858e-14 -2.65961321244e-14 -6.088271209199999e-14 ] [ -3.54081036114e-14 4.053506884019999e-14 2.77176557682e-14 ] [ 1.7623942974e-14 -1.21765424184e-14 3.0441356046e-15 ] [ -1.61819840034e-14 2.01874255884e-14 -8.010883169999999e-15 ] [ -2.67563497878e-14 -1.53808956864e-14 1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.565313005765542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.294926396873386e-18 } }