{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5558077e-10 2.374599e-10 3.8469917e-10 ] [ 1.4963033e-10 5.2811538e-10 2.785401e-10 ] [ 1.079755e-10 3.1032955e-10 2.2432565e-10 ] [ 2.7660895e-10 3.313240400000001e-10 7.184966000000001e-11 ] [ 3.0295843e-10 4.5239303e-10 4.4538663e-10 ] [ 4.3000158e-10 2.5532203e-10 2.3853683e-10 ] [ 3.8870819e-10 4.9941637e-10 2.1685095e-10 ] ] "source-value" [ [ 2.5558077 2.374599 3.8469917 ] [ 1.4963033 5.2811538 2.785401 ] [ 1.079755 3.1032955 2.2432565 ] [ 2.7660895 3.3132404 0.7184966 ] [ 3.0295843 4.5239303 4.4538663 ] [ 4.3000158 2.5532203 2.3853683 ] [ 3.8870819 4.9941637 2.1685095 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.04958298003072e-12 9.3374853460224e-13 5.908827377510401e-13 ] [ -7.334764570022399e-12 9.624755614131841e-12 5.186726374515839e-12 ] [ -8.2704357165696e-13 -4.80140289721344e-12 -1.2721282369152e-13 ] [ 2.31626674069056e-12 -5.387959758088319e-12 -2.12576794047744e-12 ] [ -1.2072400837728e-12 -1.9698761552736e-12 3.84794759017536e-12 ] [ 3.29711926794432e-12 -2.13217664696064e-12 -3.29743970326848e-12 ] [ 6.805245196848001e-12 3.73291130880192e-12 -4.0751362350048e-12 ] ] "source-value" [ [ -0.0019034 0.0005828 0.0003688 ] [ -0.004578 0.0060073 0.0032373 ] [ -0.0005162 -0.0029968 -7.94e-05 ] [ 0.0014457 -0.0033629 -0.0013268 ] [ -0.0007535 -0.0012295 0.0024017 ] [ 0.0020579 -0.0013308 -0.0020581 ] [ 0.0042475 0.0023299 -0.0025435 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.314443944349076e-18 "source-value" -14.445623 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.17715709455023e-09 -3.89610917961427e-09 1.483079622781142e-09 ] [ -5.233170270399591e-09 9.024779242316465e-09 -1.369854762295179e-09 ] [ -8.723339324172668e-09 -3.826107359351263e-09 -1.394286353585758e-09 ] [ 1.98064999196017e-09 -3.678504755330456e-09 -6.271728713440028e-09 ] [ 3.200124616844723e-09 1.393534291879955e-09 8.002405506846362e-09 ] [ -1.190266143999059e-09 -9.757662573533683e-10 6.862279480195238e-10 ] [ 6.788844035216195e-09 1.958174017452939e-09 -1.1358430881084e-09 ] ] "source-value" [ [ 1.9830255 -2.4317601 0.9256655 ] [ -3.266288 5.6328242 -0.8549961 ] [ -5.4446802 -2.3880684 -0.8702451 ] [ 1.2362245 -2.2959421 -3.9145052 ] [ 1.9973607 0.8697757 4.9947087 ] [ -0.7429057 -0.6090254 0.4283098 ] [ 4.2372632 1.2221961 -0.7089375 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.82909642039247e-18 "source-value" -11.416322 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] } "instance-id" 1 }