{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8669958 3.9247708 -10.9834797 ] [ -2.5349169 -1.6523822 -0.1883224 ] [ -2.6007998 3.8349045 1.5348342 ] [ 3.4948033 -3.7321825 -3.2872411 ] [ 2.453275 -5.3154366 8.6905811 ] [ 3.5273353 1.689037 1.9079812 ] [ 0.527299 1.251289 2.3256467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.797786884291792e-09 6.288176017758513e-09 -1.75974743903714e-08 ] [ -4.061384592850811e-09 -2.64740812946607e-09 -3.017257464529459e-10 ] [ -4.166940634941316e-09 6.144194332900713e-09 2.459075472044271e-09 ] [ 5.599292141554689e-09 -5.979615546058896e-09 -5.266740837352876e-09 ] [ 3.930579849393121e-09 -8.516268249864642e-09 1.392384585958635e-08 ] [ 5.651414151382554e-09 2.706135593066169e-09 3.056922871565929e-09 ] [ 8.448261299712192e-10 2.004785981664212e-09 3.726096770980672e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.259687 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.804000726892569e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6393448 3.327108 1.251714 ] [ 1.0873917 1.5431394 3.1561215 ] [ 1.5485885 3.9711161 3.4546371 ] [ 4.5217094 1.1102498 2.1235611 ] [ 3.2400014 1.0288479 4.2130255 ] [ 4.864675 3.5531327 2.4576128 ] [ 3.6669141 3.4707961 4.609151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6393448e-10 3.327108e-10 1.251714e-10 ] [ 1.0873917e-10 1.5431394e-10 3.1561215e-10 ] [ 1.5485885e-10 3.9711161e-10 3.4546371e-10 ] [ 4.5217094e-10 1.1102498e-10 2.1235611e-10 ] [ 3.2400014e-10 1.0288479e-10 4.2130255e-10 ] [ 4.864675e-10 3.5531327e-10 2.4576128e-10 ] [ 3.6669141e-10 3.4707961e-10 4.609151e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 -2.5e-05 -1.96e-05 ] [ -3e-07 2.3e-06 1.52e-05 ] [ -2.95e-05 7e-05 2.7e-06 ] [ 2.45e-05 -1.5e-06 -5.7e-06 ] [ 1.04e-05 -3.65e-05 1.1e-06 ] [ 1.4e-05 1.54e-05 -1.41e-05 ] [ -1.5e-05 -2.48e-05 2.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924145279999e-15 -4.005441552e-14 -3.140266176767999e-14 ] [ -4.8065298624e-16 3.68500622784e-15 2.435308463616e-14 ] [ -4.72642103136e-14 1.12152363456e-13 4.32587687616e-15 ] [ 3.92533272096e-14 -2.4032649312e-15 -9.13240673856e-15 ] [ 1.666263685632e-14 -5.84794466592e-14 1.76239428288e-15 ] [ 2.24304726912e-14 2.467351996032e-14 -2.259069035328e-14 ] [ -2.4032649312e-14 -3.973398019584e-14 3.28446207264e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.606128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.981030328521226e-18 } }