{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6561924 -0.0228707 -2.3033544 ] [ -3.208662 -1.3417969 6.593713 ] [ 5.8326218 -3.6662435 -3.0966433 ] [ 0.6371216 4.9505326 -0.6932368 ] [ -0.604889 0.0803784 -0.5004784 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.255689363626642e-09 -3.664290084133056e-11 -3.690380569096812e-09 ] [ -5.140843240449369e-09 -2.149795623041915e-09 1.056429281286503e-08 ] [ 9.344890285928414e-09 -5.873969621859965e-09 -4.961369498216961e-09 ] [ 1.020781332126689e-09 7.931627592228238e-09 -1.110687793638206e-09 ] [ -9.691390139790913e-10 1.287803932973107e-10 -8.018547916953907e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5074605 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.523263093627948e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0654503 1.9314069 0.2255072 ] [ 1.7043188 1.7570869 2.7771961 ] [ 3.1619345 0.7727029 0.8135219 ] [ 1.8753916 3.9695518 1.3540292 ] [ 3.971871 2.8108446 1.9420533 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0654503e-10 1.9314069e-10 2.255072e-11 ] [ 1.7043188e-10 1.7570869e-10 2.7771961e-10 ] [ 3.1619345e-10 7.727029e-11 8.135219e-11 ] [ 1.8753916e-10 3.9695518e-10 1.3540292e-10 ] [ 3.971871e-10 2.8108446e-10 1.9420533e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 7e-07 2e-06 ] [ 3.1e-06 1.1e-06 -3.4e-06 ] [ -1.5e-06 1.8e-06 2.6e-06 ] [ -6e-07 -6e-07 1.4e-06 ] [ -5.5e-06 -3e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 1.12152363456e-15 3.2043532416e-15 ] [ 4.96674752448e-15 1.76239428288e-15 -5.44740051072e-15 ] [ -2.4032649312e-15 2.88391791744e-15 4.16565921408e-15 ] [ -9.6130597248e-16 -9.6130597248e-16 2.24304726912e-15 ] [ -8.8119714144e-15 -4.8065298624e-15 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }