{ "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" [ [ 1.368967 3.862197 2.346954 ] [ 2.915655 3.525719 0.4290147 ] [ 3.711297 1.607736 1.156277 ] [ 3.762397 3.78477 2.460668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.368967e-10 3.862197e-10 2.346954e-10 ] [ 2.915655e-10 3.525719e-10 4.290147e-11 ] [ 3.711297e-10 1.607736e-10 1.156277e-10 ] [ 3.762397e-10 3.78477e-10 2.460668e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.423577 0.4968188 0.3173001 ] [ -2.6594819 2.0921417 -5.1215781 ] [ 1.5434938 -3.5045992 0.499281 ] [ 2.5395651 0.9156386 4.3049969 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.280821806099818e-09 7.959914726919192e-10 5.083708061858633e-10 ] [ -4.260959758725924e-09 3.351980546757038e-09 -8.205672761026114e-09 ] [ 2.472949701083869e-09 -5.614986949775092e-09 7.99936352000154e-10 ] [ 4.068831863741873e-09 1.467014770108472e-09 6.897365442622434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0738913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.731446718315884e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7810425 4.3067779 2.102699 ] [ 2.2258013 3.1424761 0.0749866 ] [ 4.0981151 2.0834325 1.0937581 ] [ 3.653357 3.2477355 3.12147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7810425e-10 4.3067779e-10 2.102699e-10 ] [ 2.2258013e-10 3.1424761e-10 7.49866e-12 ] [ 4.098115100000001e-10 2.0834325e-10 1.0937581e-10 ] [ 3.653357e-10 3.2477355e-10 3.12147e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 1.4e-06 7e-07 ] [ 6e-07 -1.4e-06 -5e-07 ] [ -0.0 3e-07 -1.2e-06 ] [ -1e-07 -4e-07 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 2.2430472876e-15 1.1215236438e-15 ] [ 9.613059803999998e-16 -2.2430472876e-15 -8.010883169999999e-16 ] [ 0.0 4.806529901999999e-16 -1.9226119608e-15 ] [ -1.602176634e-16 -6.408706536e-16 1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956251116446e-18 } }