{ "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" [ [ 2.058884 2.441785 3.519822 ] [ 1.92668 3.148467 1.175123 ] [ 5.519963 2.275692 0.7370638 ] [ 3.694005 1.670931 2.395445 ] [ 3.953137 3.917443 1.57665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.058884e-10 2.441785e-10 3.519822e-10 ] [ 1.92668e-10 3.148467e-10 1.175123e-10 ] [ 5.519963e-10 2.275692e-10 7.370638000000001e-11 ] [ 3.694005e-10 1.670931e-10 2.395445e-10 ] [ 3.953137e-10 3.917443e-10 1.57665e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6160021 1.5370714 1.7367684 ] [ -2.0063945 -1.2382527 0.6628864 ] [ -0.7759687 0.211815 0.7545672 ] [ 3.4764462 -1.5952479 -2.8094216 ] [ 2.921919 1.0846143 -0.3448004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.793474025383704e-09 2.462659861580325e-09 2.782609726224223e-09 ] [ -3.214598360001705e-09 -1.983899526582476e-09 1.062061092326277e-09 ] [ -1.243238909612569e-09 3.393650409347521e-10 1.208949926662518e-09 ] [ 5.569880825109001e-09 -2.555868889760296e-09 -4.501189605490529e-09 ] [ 4.681430309671315e-09 1.737743674045357e-09 -5.524311397224883e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.604358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.019440770779345e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7156584 2.1431868 3.5736685 ] [ 1.9058752 3.2535937 1.4953742 ] [ 5.6032477 2.1735298 0.8233336 ] [ 3.780617 1.8760649 2.3666378 ] [ 4.1472707 4.0079428 1.1450896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7156584e-10 2.1431868e-10 3.5736685e-10 ] [ 1.9058752e-10 3.2535937e-10 1.4953742e-10 ] [ 5.6032477e-10 2.1735298e-10 8.233336e-11 ] [ 3.780617e-10 1.8760649e-10 2.3666378e-10 ] [ 4.1472707e-10 4.007942800000001e-10 1.1450896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.31e-05 2.27e-05 -4.17e-05 ] [ 0.0001041 -3.92e-05 -1.07e-05 ] [ -1.7e-05 1.84e-05 -5.13e-05 ] [ -6.9e-05 5.77e-05 3.46e-05 ] [ -5.11e-05 -5.97e-05 6.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.303204614848e-14 3.636940929216e-14 -6.681076508736e-14 ] [ 1.6678658622528e-13 -6.280532353535999e-14 -1.714328984256e-14 ] [ -2.72370025536e-14 2.948004982272e-14 -8.219166064704e-14 ] [ -1.105501868352e-13 9.244559102016e-14 5.543531107968001e-14 ] [ -8.187122532288001e-14 -9.564994426176e-14 1.105501868352e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.810758 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.212727358312657e-18 } }