{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7113184 -8.4268582 -1.3796324 ] [ 1.1388792 0.3118801 -3.2188943 ] [ 10.4093289 -13.3552518 3.9333632 ] [ 5.9109178 11.0728203 -7.4032977 ] [ -5.7478076 10.3974097 8.0684613 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.876360069381427e-08 -1.35013153060713e-08 -2.210414794789341e-09 ] [ 1.824685643188613e-09 4.996870088295834e-10 -5.157237234775786e-09 ] [ 1.667758353920092e-08 -2.139747237514644e-08 6.301942612075468e-09 ] [ 9.470334384654685e-09 1.774061395714087e-08 -1.186139058948594e-08 ] [ -9.209003033447616e-09 1.665848687546495e-08 1.292710016719326e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.4681356 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.35221255386357e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0091013 0.0797967 0.7492642 ] [ -0.444688 -0.3448004 2.4828996 ] [ 3.4128712 0.2223793 1.1760843 ] [ 2.2735273 2.3209943 0.6485181 ] [ 1.9501543 3.900042 2.292086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0091013e-10 7.97967e-12 7.492642000000001e-11 ] [ -4.44688e-11 -3.448004e-11 2.4828996e-10 ] [ 3.4128712e-10 2.223793e-11 1.1760843e-10 ] [ 2.2735273e-10 2.3209943e-10 6.485181e-11 ] [ 1.9501543e-10 3.900042e-10 2.292086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 1.07e-05 6.6e-06 ] [ 6.5e-06 -7e-07 -3.8e-06 ] [ -1.24e-05 6.5e-06 -9e-07 ] [ 5e-06 -1.1e-05 2e-07 ] [ -2.4e-06 -5.6e-06 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.1269652288e-15 1.71432899838e-14 1.05743657844e-14 ] [ 1.0414148121e-14 -1.1215236438e-15 -6.088271209199999e-15 ] [ -1.98669902616e-14 1.0414148121e-14 -1.4419589706e-15 ] [ 8.010883169999999e-15 -1.7623942974e-14 3.204353268e-16 ] [ -3.845223921599999e-15 -8.972189150399999e-15 -3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.43434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992200900721156e-18 } }