{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.302316 2.639916 2.839286 ] [ 2.238062 3.048613 5.055223 ] [ 2.960065 4.797857 2.877262 ] [ 0.8426098 4.264099 3.709155 ] [ 4.78415 2.692863 2.00084 ] [ 4.277135 2.539995 4.347514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.302316e-10 2.639916e-10 2.839286e-10 ] [ 2.238062e-10 3.048613e-10 5.055223e-10 ] [ 2.960065e-10 4.797856999999999e-10 2.877262e-10 ] [ 8.426098e-11 4.264099e-10 3.709155e-10 ] [ 4.78415e-10 2.692863e-10 2.00084e-10 ] [ 4.277135e-10 2.539995e-10 4.347514000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0807878 -3.7900874 -3.8627183 ] [ -2.4707833 -1.7699637 6.8963444 ] [ 1.9327319 4.0487164 -2.9059278 ] [ -2.0009507 1.864039 -0.1500604 ] [ -1.3605445 0.3905793 0.672741 ] [ 2.8187588 -0.7432835 -0.6503789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.731612945205866e-09 -6.072389423068658e-09 -6.188756952996321e-09 ] [ -3.958631238323073e-09 -2.835794459804665e-09 1.1049161766665e-08 ] [ 3.096577864454364e-09 6.486758760329541e-09 -4.655809582892778e-09 ] [ -3.205876430913395e-09 2.986519706059411e-09 -2.404232645878963e-10 ] [ -2.179832589458026e-09 6.257770230284296e-10 1.077849902053613e-09 ] [ 4.516149449034263e-09 -1.190871446326397e-09 -1.042021868241621e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.610709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.340893637311215e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3426577 2.4737315 2.837754 ] [ 2.1318524 2.8130259 5.3049249 ] [ 2.7968993 4.7972574 2.0368764 ] [ 1.2390589 4.4831159 3.8331874 ] [ 4.6524407 3.3212578 2.398376 ] [ 4.2414288 2.0949545 4.4181613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3426577e-10 2.4737315e-10 2.837754e-10 ] [ 2.1318524e-10 2.8130259e-10 5.3049249e-10 ] [ 2.7968993e-10 4.7972574e-10 2.0368764e-10 ] [ 1.2390589e-10 4.4831159e-10 3.8331874e-10 ] [ 4.6524407e-10 3.3212578e-10 2.398376e-10 ] [ 4.241428800000001e-10 2.0949545e-10 4.418161300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 -1.25e-05 -3.4e-06 ] [ -6.9e-06 3e-07 -9.4e-06 ] [ -3.9e-06 -1.68e-05 -1.5e-05 ] [ 1.83e-05 8.3e-06 2.18e-05 ] [ 1.7e-06 2.04e-05 8.6e-06 ] [ -1.1e-05 3e-07 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-15 -2.002720776e-14 -5.44740051072e-15 ] [ -1.105501868352e-14 4.8065298624e-16 -1.506046023552e-14 ] [ -6.24848882112e-15 -2.691656722944e-14 -2.4032649312e-14 ] [ 2.931983216064e-14 1.329806595264e-14 3.492745033344e-14 ] [ 2.72370025536e-15 3.268440306432e-14 1.377871893888e-14 ] [ -1.76239428288e-14 4.8065298624e-16 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.705886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.836795659975003e-18 } }