{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5365084 0.1055562 0.1335119 ] [ -2.9830056 -7.2648043 1.8858761 ] [ -8.7035625 -0.3150007 -2.776896 ] [ 3.4437393 6.4694517 4.284769 ] [ -1.0569539 -0.1053055 -2.1795327 ] [ 4.3580009 3.5984557 -0.6132902 ] [ 3.4052733 -2.488353 -0.7344381 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.461757836142815e-09 1.69119675820489e-10 2.139096447785875e-10 ] [ -4.779301832035476e-09 -1.163949960414731e-08 3.021506597145483e-09 ] [ -1.39446443551716e-08 -5.046867570756347e-10 -4.449077849593036e-09 ] [ 5.517478594590157e-09 1.036520426313481e-08 6.864956717328595e-09 ] [ -1.693426827843381e-09 -1.687180101416544e-10 -3.491996336209101e-09 ] [ 6.982287155405359e-09 5.765361593524499e-09 -9.825992202057562e-10 ] [ 5.455849268694466e-09 -3.986781000897542e-09 -1.176699553244772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.517717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.966865324799072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2422153 0.7617631 1.9386458 ] [ 1.837827 2.3539031 3.2686644 ] [ 1.3587953 4.4392386 1.8685261 ] [ 3.2812444 4.5494319 3.6382595 ] [ 4.4428132 2.2764217 3.4876428 ] [ 3.4363616 5.7127931 1.4249502 ] [ 3.5803343 3.171013 1.1342167 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2422153e-10 7.617631e-11 1.9386458e-10 ] [ 1.837827e-10 2.3539031e-10 3.2686644e-10 ] [ 1.3587953e-10 4.4392386e-10 1.8685261e-10 ] [ 3.2812444e-10 4.5494319e-10 3.6382595e-10 ] [ 4.4428132e-10 2.2764217e-10 3.4876428e-10 ] [ 3.4363616e-10 5.7127931e-10 1.4249502e-10 ] [ 3.5803343e-10 3.171013e-10 1.1342167e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 -2.7e-05 -4e-07 ] [ -4.4e-06 2.1e-05 -3e-05 ] [ -2.44e-05 -4.71e-05 6e-07 ] [ 2.95e-05 1.58e-05 1.56e-05 ] [ -7.3e-06 1.77e-05 4.6e-06 ] [ 3.46e-05 4.15e-05 1.5e-05 ] [ -3.88e-05 -2.2e-05 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.730350750464e-14 -4.32587687616e-14 -6.408706483200001e-16 ] [ -7.04957713152e-15 3.36457090368e-14 -4.8065298624e-14 ] [ -3.909310954752e-14 -7.546251883968001e-14 9.6130597248e-16 ] [ 4.72642103136e-14 2.531439060864e-14 2.499395528448e-14 ] [ -1.169588933184e-14 2.835852618816e-14 7.370012455680001e-15 ] [ 5.543531107968001e-14 6.64903297632e-14 2.4032649312e-14 ] [ -6.216445288704e-14 -3.52478856576e-14 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.579661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.777878158058956e-18 } }