{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8117588 -9.9617407 1.4681259 ] [ -10.500535 5.2473467 -1.1226516 ] [ 0.9531618 4.3431913 -2.2960443 ] [ 6.5588352 -3.1450956 -7.35797 ] [ 4.8002967 3.5162984 9.30854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.902757615803879e-09 -1.59604681835068e-08 2.35219701275022e-09 ] [ -1.682371182149919e-08 8.407176273237007e-09 -1.798686161642714e-09 ] [ 1.527133564381381e-09 6.958559617852084e-09 -3.678668528088886e-09 ] [ 1.050841250369672e-08 -5.03899868201621e-09 -1.178876760767298e-08 ] [ 7.690923209007307e-09 5.633731134651585e-09 1.491392528465436e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3622125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.989034940042724e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4028829 -0.6913872 2.5033848 ] [ 1.721593 2.7977373 1.5433691 ] [ 2.5554616 4.7499273 0.4152315 ] [ 3.2780451 1.5245856 2.0101351 ] [ 4.2585765 2.1769318 4.1391585 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4028829e-10 -6.913872e-11 2.5033848e-10 ] [ 1.721593e-10 2.7977373e-10 1.5433691e-10 ] [ 2.5554616e-10 4.749927300000001e-10 4.152315e-11 ] [ 3.2780451e-10 1.5245856e-10 2.0101351e-10 ] [ 4.2585765e-10 2.1769318e-10 4.1391585e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 9.4e-06 3e-07 ] [ 4.7e-06 3.6e-06 5.8e-06 ] [ 1e-06 -1.23e-05 6.3e-06 ] [ 5e-07 2e-07 -2.7e-06 ] [ -1.01e-05 -9e-07 -9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 1.50604603596e-14 4.806529901999999e-16 ] [ 7.530230179799999e-15 5.767835882399999e-15 9.2926244772e-15 ] [ 1.602176634e-15 -1.97067725982e-14 1.00937127942e-14 ] [ 8.010883169999999e-16 3.204353268e-16 -4.3258769118e-15 ] [ -1.61819840034e-14 -1.4419589706e-15 -1.55411133498e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.424002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.830326907116927e-18 } }