{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8731175 0.3639227 0.3135117 ] [ 1.4867984 -0.3681054 -0.1531101 ] [ 1.0059481 1.0681869 0.2571598 ] [ -0.1090117 -0.4953414 0.367472 ] [ 0.0699233 -0.157396 -0.6381792 ] [ -0.4438599 1.0358441 0.3275945 ] [ -1.1366807 -1.4471109 -0.4744488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.398888457236495e-09 5.830684465221917e-10 5.023011202256178e-10 ] [ 2.382113655948586e-09 -5.897698707292237e-10 -2.453094246494034e-10 ] [ 1.611706540836695e-09 1.711424091924894e-09 4.120154227641132e-10 ] [ -1.746559985726178e-10 -7.936244169328475e-10 5.88755052049248e-10 ] [ 1.120294774321722e-10 -2.52176193485064e-10 -1.022475802544813e-09 ] [ -7.111419605495765e-10 1.659605213486759e-09 5.24864253326913e-10 ] [ -1.821163257858764e-09 -2.318527270786711e-09 -7.60150781389339e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.604447005765541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.500108037912881e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1418962 1.9526964 1.3311514 ] [ 2.5083571 4.1330144 1.780961 ] [ 5.305233 2.7038453 1.5003523 ] [ 3.3634055 0.9867794 3.4394895 ] [ 5.7348879 1.3359493 3.2854896 ] [ 4.4372153 2.85808 4.6153323 ] [ 4.539589 4.3875392 2.8611166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1418962e-10 1.9526964e-10 1.3311514e-10 ] [ 2.5083571e-10 4.133014400000001e-10 1.780961e-10 ] [ 5.305233000000001e-10 2.7038453e-10 1.5003523e-10 ] [ 3.3634055e-10 9.867794e-11 3.4394895e-10 ] [ 5.7348879e-10 1.3359493e-10 3.2854896e-10 ] [ 4.4372153e-10 2.858080000000001e-10 4.615332300000001e-10 ] [ 4.539589000000001e-10 4.3875392e-10 2.8611166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.14e-05 -1.31e-05 7.4e-06 ] [ -3.4e-06 -1.28e-05 -1.13e-05 ] [ -1.28e-05 3e-06 1.24e-05 ] [ 2.7e-06 1.77e-05 -1.39e-05 ] [ -4.03e-05 -2.16e-05 -9.6e-06 ] [ 4e-05 1.36e-05 -9.3e-06 ] [ -1.75e-05 1.32e-05 2.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.030834630759999e-14 -2.09885139054e-14 1.18561070916e-14 ] [ -5.4474005556e-15 -2.05078609152e-14 -1.81045959642e-14 ] [ -2.05078609152e-14 4.806529901999999e-15 1.98669902616e-14 ] [ 4.3258769118e-15 2.83585264218e-14 -2.22702552126e-14 ] [ -6.456771835019998e-14 -3.46070152944e-14 -1.53808956864e-14 ] [ 6.408706535999999e-14 2.17896022224e-14 -1.49002426962e-14 ] [ -2.8038091095e-14 2.11487315688e-14 3.893289220619999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.329594005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.257160049474401e-18 } }