{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.4740278 2.9715628 -3.3675131 ] [ -41.7402154 -19.4862501 28.7440262 ] [ -25.0883318 -11.3528397 9.1830991 ] [ 16.1707509 -4.2447878 -18.0542391 ] [ 58.799058 -14.0452299 -22.9728587 ] [ 7.9929276 37.9706001 19.8141355 ] [ 18.3398386 8.1869445 -13.3466499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.523348136596927e-08 4.760968445398987e-09 -5.395350759057733e-09 ] [ -6.687519726103612e-08 -3.122041433728166e-08 4.605300676530266e-08 ] [ -4.019593866483318e-08 -1.818925434703009e-08 1.471294668450952e-08 ] [ 2.590839903276056e-08 -6.800899773417067e-09 -2.892607979235323e-08 ] [ 9.420647605266321e-08 -2.250293897954112e-08 -3.680657712208188e-08 ] [ 1.280608173246705e-08 6.083560775796614e-08 3.174574465946332e-08 ] [ 2.938366063416541e-08 1.311693107368715e-08 -2.138369043578266e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.475767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.280579518034816e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5373959 2.8489346 2.6864458 ] [ 2.6583728 0.5625329 5.65256 ] [ 1.4682326 0.104197 3.254603 ] [ 3.7769412 0.8433481 1.7824332 ] [ 5.1017488 0.7980605 4.2081199 ] [ 3.5032779 3.2334478 5.0036225 ] [ 4.3811379 3.5728816 2.2778086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5373959e-10 2.8489346e-10 2.6864458e-10 ] [ 2.6583728e-10 5.625329000000001e-11 5.65256e-10 ] [ 1.4682326e-10 1.04197e-11 3.254603e-10 ] [ 3.7769412e-10 8.433481e-11 1.7824332e-10 ] [ 5.1017488e-10 7.980605e-11 4.2081199e-10 ] [ 3.5032779e-10 3.2334478e-10 5.0036225e-10 ] [ 4.3811379e-10 3.5728816e-10 2.2778086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 1.22e-05 -1.76e-05 ] [ 6.5e-06 -9.7e-06 -1.66e-05 ] [ -1.48e-05 -6e-06 5.3e-06 ] [ -4e-07 -1.03e-05 -8.4e-06 ] [ 1.66e-05 1.21e-05 3.5e-06 ] [ 1.03e-05 2.16e-05 1.11e-05 ] [ -1.2e-06 -1.98e-05 2.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-14 1.954655477376e-14 -2.819830852608e-14 ] [ 1.04141480352e-14 -1.554111322176e-14 -2.659613190528e-14 ] [ -2.371221398784e-14 -9.6130597248e-15 8.491536090240001e-15 ] [ -6.408706483200001e-16 -1.650241919424e-14 -1.345828361472e-14 ] [ 2.659613190528e-14 1.938633711168e-14 5.6076181728e-15 ] [ 1.650241919424e-14 3.460701500928e-14 1.778416049088e-14 ] [ -1.92261194496e-15 -3.172309709184e-14 3.620919163008e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.983946 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.041563445172968e-18 } }