{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.034718 3.53714 2.04977 ] [ 2.090115 3.249613 4.258758 ] [ 4.260617 1.92046 3.281861 ] [ 5.152468 4.155846 3.194292 ] [ 3.505339 5.178097 3.977293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.034718e-10 3.53714e-10 2.04977e-10 ] [ 2.090115e-10 3.249613e-10 4.258758e-10 ] [ 4.260617e-10 1.92046e-10 3.281861e-10 ] [ 5.152468e-10 4.155846e-10 3.194292e-10 ] [ 3.505339e-10 5.178097e-10 3.977293e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5970237 -0.9959084 -6.8234573 ] [ -2.9906296 -0.8226038 2.588914 ] [ 1.6122493 -3.8532777 0.7633793 ] [ 6.4664674 0.6586605 -0.1316258 ] [ -1.4910634 5.0131294 3.6027899 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.763067276603513e-09 -1.595621154938335e-09 -1.093238375908709e-08 ] [ -4.791516826592456e-09 -1.317956576541239e-09 4.147897484061811e-09 ] [ 2.583108135361166e-09 -6.173631444389996e-09 1.223068467262669e-09 ] [ 1.036042288744536e-08 1.055290454144438e-09 -2.108877794540966e-10 ] [ -2.388946919610558e-09 8.031918721725132e-09 5.77230574743437e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7573742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.019977098837104e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4287303 2.3910656 2.320943 ] [ 1.7281561 4.141051 3.6951309 ] [ 4.7598953 2.3228596 2.3725555 ] [ 5.5000953 4.0312455 3.7779663 ] [ 3.62638 5.1549344 4.5953783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4287303e-10 2.3910656e-10 2.320943e-10 ] [ 1.7281561e-10 4.141051e-10 3.6951309e-10 ] [ 4.7598953e-10 2.3228596e-10 2.3725555e-10 ] [ 5.5000953e-10 4.0312455e-10 3.7779663e-10 ] [ 3.62638e-10 5.154934400000001e-10 4.5953783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.56e-05 -2.88e-05 -1.2e-06 ] [ 1.26e-05 2.1e-05 -4e-07 ] [ 9.6e-06 2.1e-05 -1.5e-06 ] [ 9e-06 -1.36e-05 -2.7e-06 ] [ -1.56e-05 4e-07 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.499395528448e-14 -4.614268667904e-14 -1.92261194496e-15 ] [ 2.018742542208e-14 3.36457090368e-14 -6.408706483200001e-16 ] [ 1.538089555968e-14 3.36457090368e-14 -2.4032649312e-15 ] [ 1.44195895872e-14 -2.178960204288e-14 -4.32587687616e-15 ] [ -2.499395528448e-14 6.408706483200001e-16 9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }