{ "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" [ [ -4.7878544 -9.7885762 -0.2004559 ] [ -9.0249949 5.2576575 2.7301225 ] [ -12.0819331 -2.4156152 -5.4504602 ] [ 5.0116243 -4.0701767 0.0380496 ] [ 12.131351 -7.0625145 3.5376609 ] [ 7.2588511 6.9757456 -3.5292191 ] [ 1.4929559 11.1034795 2.8743022 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.670988383474411e-09 -1.568302793855931e-08 -3.211657564814227e-10 ] [ -1.445963583161923e-08 8.423695926673776e-09 4.374138441420047e-09 ] [ -1.935739074688967e-08 -3.870242198289116e-09 -8.732599905040893e-09 ] [ 8.029507285693167e-09 -6.521141951264896e-09 6.096217955079169e-11 ] [ 1.94365669509187e-08 -1.1315395615961e-08 5.667957586298287e-09 ] [ 1.162996152628836e-08 1.117637651296847e-08 -5.654432331700817e-09 ] [ 2.391979038865423e-09 1.778973526443207e-08 4.605139785954005e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.068357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.894869916166802e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5304469 2.7547829 0.4494093 ] [ 1.6924143 4.9951457 1.2587411 ] [ 2.0864067 3.0959193 2.8756213 ] [ 4.9850726 2.4757665 0.9614792 ] [ 4.5492424 2.8106275 3.3428968 ] [ 4.0735334 4.771619 0.448243 ] [ 3.6294786 5.1127629 2.8744481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5304469e-10 2.7547829e-10 4.494093e-11 ] [ 1.6924143e-10 4.995145700000001e-10 1.2587411e-10 ] [ 2.0864067e-10 3.0959193e-10 2.8756213e-10 ] [ 4.9850726e-10 2.4757665e-10 9.614792e-11 ] [ 4.5492424e-10 2.8106275e-10 3.3428968e-10 ] [ 4.0735334e-10 4.771619e-10 4.48243e-11 ] [ 3.6294786e-10 5.1127629e-10 2.8744481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.46e-05 -0.0001641 -4.21e-05 ] [ 2.77e-05 2.47e-05 1.04e-05 ] [ 1.75e-05 -9.03e-05 8.2e-06 ] [ -4.1e-06 -5.1e-06 6.82e-05 ] [ -9.53e-05 -1.81e-05 -8.23e-05 ] [ 5e-06 0.0001056 -3.48e-05 ] [ 9.39e-05 0.0001473 7.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.145707728768e-14 -2.6291718347328e-13 -6.745163573568001e-14 ] [ 4.438029239616e-14 3.957376253376001e-14 1.666263685632e-14 ] [ 2.8038090864e-14 -1.4467654885824e-13 1.313784829056e-14 ] [ -6.568924145279999e-15 -8.17110076608e-15 1.0926844553856e-13 ] [ -1.5268743196224e-13 -2.899939683648e-14 -1.3185913589184e-13 ] [ 8.010883104e-15 1.6918985115648e-13 -5.575574640383999e-14 ] [ 1.5044438469312e-13 2.3600061624384e-13 1.1599758734592e-13 ] ] } "relaxed-potential-energy" { "source-value" -26.566249 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.256382305015138e-18 } }