{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7486818 -3.9402797 1.1079692 ] [ -5.2284273 0.8555855 1.5593673 ] [ -4.7039006 -4.0327379 -2.9295141 ] [ 2.6775713 -1.2573392 0.5895871 ] [ 2.611516 -2.3358813 0.7918908 ] [ 6.8089529 3.8280301 -2.1859332 ] [ 2.5829695 6.8826225 1.0666329 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.608226959578462e-09 -6.313024014752838e-09 1.77516234880648e-09 ] [ -8.376863983612468e-09 1.370799085195479e-09 2.49838183130002e-09 ] [ -7.536479567887093e-09 -6.461158381194088e-09 -4.693599001323954e-09 ] [ 4.289942137385063e-09 -2.014479470655376e-09 9.446226675452717e-10 ] [ 4.184109880045133e-09 -3.742494407823911e-09 1.268748925986609e-09 ] [ 1.090914514850836e-08 6.133180329938686e-09 -3.502251067670531e-09 ] [ 4.138373345139466e-09 1.102717685929205e-08 1.708934295356105e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.132867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104117247147583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5104245 2.6701239 0.4026222 ] [ 1.6613667 5.0189443 1.2447626 ] [ 2.0413173 3.025121 2.9262431 ] [ 4.9673767 2.4917858 0.9789052 ] [ 4.5315951 2.8215606 3.3232426 ] [ 4.1518116 4.817048 0.4057201 ] [ 3.6827031 5.1720403 2.9293429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5104245e-10 2.6701239e-10 4.026222e-11 ] [ 1.6613667e-10 5.0189443e-10 1.2447626e-10 ] [ 2.0413173e-10 3.025121e-10 2.9262431e-10 ] [ 4.9673767e-10 2.4917858e-10 9.789052e-11 ] [ 4.5315951e-10 2.8215606e-10 3.3232426e-10 ] [ 4.151811600000001e-10 4.817048e-10 4.057201e-11 ] [ 3.6827031e-10 5.1720403e-10 2.9293429e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.45e-05 1.81e-05 -6.4e-06 ] [ -7.6e-06 3e-06 -5.8e-06 ] [ -3.5e-06 -2.07e-05 -9.4e-06 ] [ -1.39e-05 1.4e-05 6.5e-06 ] [ 1.3e-06 2.4e-06 9.9e-06 ] [ -2.03e-05 -2.79e-05 7.8e-06 ] [ 2.94e-05 1.13e-05 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.32315610016e-14 2.899939683648e-14 -1.025393037312e-14 ] [ -1.217654231808e-14 4.8065298624e-15 -9.292624400640001e-15 ] [ -5.6076181728e-15 -3.316505605055999e-14 -1.506046023552e-14 ] [ -2.227025502912e-14 2.24304726912e-14 1.04141480352e-14 ] [ 2.08282960704e-15 3.84522388992e-15 1.586154854592e-14 ] [ -3.252418540224e-14 -4.470072772032e-14 1.249697764224e-14 ] [ 4.710399265152e-14 1.810459581504e-14 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.023701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.727497574168958e-18 } }