{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2025958 -2.8944662 0.0214475 ] [ 1.3182163 -0.1929469 -0.4435437 ] [ 0.3475987 2.3276021 0.3298281 ] [ 0.3326236 0.7095462 0.8449674 ] [ -0.7958428 0.0502648 -0.7526993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.926770875032273e-09 -4.637446075335817e-09 3.4362683074608e-11 ] [ 2.112015337017479e-09 -3.091350122358355e-10 -7.10635346443129e-10 ] [ 5.56914510560473e-10 3.729229667144984e-09 5.284428707028845e-10 ] [ 5.329217554463309e-10 1.136818333017481e-09 1.353787013618162e-09 ] [ -1.27508072799201e-09 8.053308740918784e-11 -1.205957220952525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7895213992349497 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.07148258987554e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7174953 1.6942204 1.4961486 ] [ 1.4173863 2.6056756 3.6457931 ] [ 2.3623686 3.9292267 1.9275319 ] [ 4.0012807 2.2597895 1.5751781 ] [ 3.7011728 3.1712378 3.7248262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7174953e-10 1.6942204e-10 1.4961486e-10 ] [ 1.4173863e-10 2.6056756e-10 3.6457931e-10 ] [ 2.3623686e-10 3.9292267e-10 1.9275319e-10 ] [ 4.0012807e-10 2.2597895e-10 1.5751781e-10 ] [ 3.7011728e-10 3.1712378e-10 3.7248262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 -7e-07 -6.6e-06 ] [ 3e-07 -4.3e-06 3.8e-06 ] [ 7.9e-06 -2.4e-06 6e-07 ] [ -8e-06 2e-06 6.9e-06 ] [ 1.1e-06 5.3e-06 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08282960704e-15 -1.12152363456e-15 -1.057436569728e-14 ] [ 4.8065298624e-16 -6.889359469440001e-15 6.08827115904e-15 ] [ 1.265719530432e-14 -3.84522388992e-15 9.6130597248e-16 ] [ -1.28174129664e-14 3.2043532416e-15 1.105501868352e-14 ] [ 1.76239428288e-15 8.491536090240001e-15 -7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }