{ "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" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1123596 -18.588785 0.1005767 ] [ -20.5242955 17.8801823 9.7958071 ] [ -1.4335646 -2.1410289 2.9389994 ] [ 23.0702197 2.8496316 -12.8353832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.78219654504244e-09 -2.978251673607773e-08 1.611416373372154e-10 ] [ -3.288354640849065e-08 2.864721005670197e-08 1.569461311748665e-08 ] [ -2.296823686526504e-09 -3.430306448037141e-09 4.708796127225228e-09 ] [ 3.696256664005959e-08 4.565613127412897e-09 -2.056455088204909e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9188034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.48296843059155e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4730691 0.0384769 2.9086276 ] [ 0.0037866 1.7669412 3.4331017 ] [ 2.6347493 2.6734798 -0.0524366 ] [ 3.1934586 2.2556637 1.6785058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.730691e-11 3.84769e-12 2.9086276e-10 ] [ 3.7866e-13 1.7669412e-10 3.4331017e-10 ] [ 2.6347493e-10 2.6734798e-10 -5.24366e-12 ] [ 3.1934586e-10 2.2556637e-10 1.6785058e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -21.568291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.455621159081105e-18 } }