{ "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" [ [ 0.030246 0.3236526 0.7484261 ] [ 0.2346781 2.328783 2.431887 ] [ 2.977482 1.327807 0.9963536 ] [ 1.948854 0.1474915 2.662758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0246e-12 3.236526e-11 7.484261e-11 ] [ 2.346781e-11 2.328783e-10 2.431887e-10 ] [ 2.977482e-10 1.327807e-10 9.963536e-11 ] [ 1.948854e-10 1.474915e-11 2.662758e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5487571 1.2149655 1.7817515 ] [ 1.0484928 -2.2048573 -1.00621 ] [ -0.9414501 0.0002144 0.0540492 ] [ -1.6557998 0.9896774 -0.8295907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.481382416918008e-09 1.946589319178582e-09 2.854680597375331e-09 ] [ 1.67987065123713e-09 -3.532570818260212e-09 -1.612126137615168e-09 ] [ -1.508369339869822e-09 3.4350666749952e-13 8.659636461294337e-11 ] [ -2.652883728285316e-09 1.58563799241413e-09 -1.329150824373106e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3115586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.171440825052918e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3863074 1.2058924 0.3384199 ] [ 0.010667 1.5244403 2.6278146 ] [ 2.5849633 0.5394275 0.7918976 ] [ 2.2093224 0.8579739 3.0812926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.863074e-11 1.2058924e-10 3.384199e-11 ] [ 1.0667e-12 1.5244403e-10 2.6278146e-10 ] [ 2.5849633e-10 5.394274999999999e-11 7.918976e-11 ] [ 2.2093224e-10 8.579739e-11 3.0812926e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.7e-06 1.2e-06 -1.1e-06 ] [ 1e-06 -1e-06 -2.9e-06 ] [ -1.1e-06 3e-07 3.4e-06 ] [ 2.9e-06 -5e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.32587687616e-15 1.92261194496e-15 -1.76239428288e-15 ] [ 1.6021766208e-15 -1.6021766208e-15 -4.646312200320001e-15 ] [ -1.76239428288e-15 4.8065298624e-16 5.44740051072e-15 ] [ 4.646312200320001e-15 -8.010883104e-16 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }