{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.356272 -32.8537383 25.5692559 ] [ 18.3179439 36.1595517 -40.0979769 ] [ -61.3524379 8.6145874 23.350848 ] [ 103.6012393 12.3312635 87.2634255 ] [ -41.2104732 -24.2516644 -96.0855525 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.101216646424566e-08 -5.263749141014154e-08 4.096646401423247e-08 ] [ 2.934858145770597e-08 5.79339883523489e-08 -6.424404113055846e-08 ] [ -9.829744163246385e-08 1.380209053011826e-08 3.741218274145444e-08 ] [ 1.659874834923662e-07 1.975686208462438e-08 1.398114201870225e-07 ] [ -6.602645669314497e-08 -3.885544971716766e-08 -1.53946025812151e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 52.513224 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.413545977563346e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7897942 0.2160922 2.6076649 ] [ 0.9558309 2.5811872 0.2892241 ] [ -0.5082865 2.0584676 2.0196995 ] [ 3.0409138 0.8080263 3.0812201 ] [ 2.2971586 0.7542304 0.8259883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.897942000000001e-11 2.160922e-11 2.6076649e-10 ] [ 9.558309000000001e-11 2.5811872e-10 2.892241e-11 ] [ -5.082865e-11 2.0584676e-10 2.0196995e-10 ] [ 3.0409138e-10 8.080263e-11 3.0812201e-10 ] [ 2.2971586e-10 7.542304e-11 8.259883e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 -1.86e-05 -1.35e-05 ] [ 6.2e-06 -9.3e-06 -1.92e-05 ] [ 6.72e-05 -2.07e-05 2.18e-05 ] [ 2e-06 2.5e-05 4.96e-05 ] [ -4.19e-05 2.37e-05 -3.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313445888e-14 -2.980048514688e-14 -2.16293843808e-14 ] [ 9.93349504896e-15 -1.490024257344e-14 -3.076179111936e-14 ] [ 1.0766626891776e-13 -3.316505605055999e-14 3.492745033344e-14 ] [ 3.2043532416e-15 4.005441552e-14 7.946796039168e-14 ] [ -6.713120041152e-14 3.797158591296e-14 -6.200423522496e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.846255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21841460466351e-18 } }