{ "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" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2102334 0.3876551 -0.1348427 ] [ -5.5537988 -0.4593793 -2.7983328 ] [ 4.3650206 2.7454567 -2.6405474 ] [ 0.9785448 -2.6737325 5.5737229 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.368310383912947e-10 6.21091938153886e-10 -2.160418214255482e-10 ] [ -8.898166593987095e-09 -7.360067745394695e-10 -4.483423389377802e-09 ] [ 6.993533954630389e-09 4.398706538158719e-09 -4.230623310394226e-09 ] [ 1.567801600965412e-09 -4.283791701773136e-09 8.930088521197577e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5348832 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.867860461898691e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7263259 2.2630687 2.7662252 ] [ 1.7834563 3.7903934 0.9311363 ] [ 3.8789693 4.6379867 1.7018165 ] [ 3.8218385 3.1106623 3.5369059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7263259e-10 2.2630687e-10 2.7662252e-10 ] [ 1.7834563e-10 3.7903934e-10 9.311363e-11 ] [ 3.8789693e-10 4.6379867e-10 1.7018165e-10 ] [ 3.8218385e-10 3.1106623e-10 3.5369059e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 0.0 8e-07 ] [ 0.0 1.1e-06 -1.6e-06 ] [ -1.1e-06 -7e-07 2e-07 ] [ 4e-07 -4e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 0.0 1.28174129664e-15 ] [ 0.0 1.76239428288e-15 -2.56348259328e-15 ] [ -1.76239428288e-15 -1.12152363456e-15 3.2043532416e-16 ] [ 6.408706483200001e-16 -6.408706483200001e-16 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.1407198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.304287094004365e-18 } }