{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.374644 -8.4423863 -10.2001681 ] [ -14.1934664 -47.424941 11.2630347 ] [ 10.7059299 3.3136828 -7.5426951 ] [ 5.8621805 52.5536444 6.4798285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.804599099522995e-09 -1.352619395362222e-08 -1.634247085804996e-08 ] [ -2.274044003419034e-08 -7.598313171301938e-08 1.804537087559914e-08 ] [ 1.715279058970368e-08 5.309105110907083e-09 -1.208472974704272e-08 ] [ 9.392248544009655e-09 8.420022039551684e-08 1.038182972949353e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.3431376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.016282676523742e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.834174 -0.0755529 -0.1367235 ] [ 1.0037454 0.583327 2.0106962 ] [ 3.2007748 3.0135653 0.5394095 ] [ 1.4243422 2.8156352 1.910322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.34174e-11 -7.555290000000001e-12 -1.367235e-11 ] [ 1.0037454e-10 5.83327e-11 2.0106962e-10 ] [ 3.2007748e-10 3.0135653e-10 5.394095e-11 ] [ 1.4243422e-10 2.8156352e-10 1.910322e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -1e-06 -1e-06 ] [ 2.6e-06 -4e-07 -1.7e-06 ] [ -2.6e-06 -3.7e-06 1.6e-06 ] [ 2e-07 5.1e-06 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 -1.6021766208e-15 -1.6021766208e-15 ] [ 4.16565921408e-15 -6.408706483200001e-16 -2.72370025536e-15 ] [ -4.16565921408e-15 -5.928053496960001e-15 2.56348259328e-15 ] [ 3.2043532416e-16 8.17110076608e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9904386 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.440427053565788e-18 } }