{ "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" [ [ -0.522066 -7.8352982 0.0859509 ] [ -7.31084 7.2930522 3.3612978 ] [ -0.449715 -0.1056078 -0.2036738 ] [ 8.2826211 0.6478538 -3.2435748 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.36441946605844e-10 -1.255353169646226e-08 1.377085236512706e-10 ] [ -1.171325702291256e-08 1.168475782538229e-08 5.385392795075605e-09 ] [ -7.205228649593099e-10 -1.692023495281452e-10 -3.263214033179891e-10 ] [ 1.327022199469538e-08 1.037976220608109e-09 -5.196779755191224e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.738143346151739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.98916592374689e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9772457 0.0733651 2.4830519 ] [ 0.3839409 2.2591563 3.1920031 ] [ 2.3790312 2.5361502 0.0353783 ] [ 2.5648459 1.8658901 2.2573652 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.772457e-11 7.33651e-12 2.4830519e-10 ] [ 3.839409e-11 2.2591563e-10 3.1920031e-10 ] [ 2.3790312e-10 2.5361502e-10 3.53783e-12 ] [ 2.5648459e-10 1.8658901e-10 2.2573652e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 3.2e-06 -1.3e-06 ] [ 1e-06 -1.8e-06 -1e-07 ] [ -5e-07 -1.5e-06 1e-07 ] [ -1e-06 1e-07 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883169999999e-16 5.1269652288e-15 -2.0828296242e-15 ] [ 1.602176634e-15 -2.8839179412e-15 -1.602176634e-16 ] [ -8.010883169999999e-16 -2.403264951e-15 1.602176634e-16 ] [ -1.602176634e-15 1.602176634e-16 2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.354380646151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.178301682880614e-18 } }