{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3692344 -3.9895097 6.2044998 ] [ 3.404235 2.3737964 -6.4886249 ] [ -7.3786573 0.2968443 0.620546 ] [ -1.1176123 0.9965647 5.5855289 ] [ 2.7228002 0.3223043 -5.9219499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.795931996149009e-09 -6.391899222456349e-09 9.940704605217671e-09 ] [ 5.454185773644988e-09 3.803241125953316e-09 -1.039592320157059e-08 ] [ -1.182191231635353e-08 4.755970013960861e-10 9.94224301522164e-10 ] [ -1.790612312930998e-09 1.59667267660922e-09 8.949003892111722e-09 ] [ 4.362406859490526e-09 5.163884184977261e-10 -9.488009757498636e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.01226237402345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.283705956113774e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0312335 0.8938325 1.2714591 ] [ 1.1315352 0.1338515 2.8605903 ] [ 2.869901 0.6015121 1.999705 ] [ 2.9089544 2.89953 0.459259 ] [ 2.301485 3.0006291 2.1939772 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0312335e-10 8.938325000000001e-11 1.2714591e-10 ] [ 1.1315352e-10 1.338515e-11 2.8605903e-10 ] [ 2.869901e-10 6.015121000000001e-11 1.999705e-10 ] [ 2.9089544e-10 2.89953e-10 4.59259e-11 ] [ 2.301485e-10 3.0006291e-10 2.1939772e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -127.8796604 -24.4743522 44.9347331 ] [ -116.4585385 -15.1462388 -28.8661039 ] [ 209.5381942 91.45793 -4.8113839 ] [ 24.4391123 -4.4369604 -27.5281482 ] [ 10.3608925 -47.4003787 16.2709028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.048858038567351e-07 -3.921223522712648e-08 7.199337942784637e-08 ] [ -1.865871492144894e-07 -2.42669498983442e-08 -4.624859718319626e-08 ] [ 3.357171986777943e-07 1.465317584400076e-07 -7.708686861783792e-09 ] [ 3.9155774682762e-08 -7.108794278863294e-09 -4.410495582332915e-08 ] [ 1.659997987088584e-08 -7.594377919589129e-08 2.606886028024518e-08 ] ] } "relaxed-potential-energy" { "source-value" 5.81566937402345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.317729582129778e-19 } }