{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7920125 2.8335294 2.1722026 ] [ 2.4587555 -3.3281708 0.9936171 ] [ -2.1332982 2.7899596 -2.5429083 ] [ 6.1813903 -2.7356927 -2.1484856 ] [ 0.8807783 1.1859117 -0.1443307 ] [ -1.9412794 -0.4443863 -2.1494891 ] [ 1.345666 -0.3011509 3.819394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.088200363568136e-08 4.539814559029452e-09 3.480252221360974e-09 ] [ 3.939360578363415e-09 -5.332317445789233e-09 1.591950087647096e-09 ] [ -3.417920501234723e-09 4.47000804409652e-09 -4.074188227098273e-09 ] [ 9.9036790226999e-09 -4.383062885633229e-09 -3.44225339844546e-09 ] [ 1.411162400367969e-09 1.900040000073183e-09 -2.312432732036986e-10 ] [ -3.110272469120652e-09 -7.119853404638151e-10 -3.443861182684433e-09 ] [ 2.155994604605453e-09 -4.824969313128787e-10 6.119343772423796e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.59231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.978816440866605e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5749607 2.4214277 3.5723237 ] [ 1.6019381 4.5512344 3.1353849 ] [ 2.9046428 3.606136 1.3793826 ] [ 4.7584195 2.2857024 2.3860099 ] [ 4.625032 2.6893096 4.8238413 ] [ 5.1374179 4.5303926 1.415741 ] [ 6.1715081 3.9744454 3.5107317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5749607e-10 2.4214277e-10 3.5723237e-10 ] [ 1.6019381e-10 4.5512344e-10 3.1353849e-10 ] [ 2.9046428e-10 3.606136e-10 1.3793826e-10 ] [ 4.7584195e-10 2.2857024e-10 2.3860099e-10 ] [ 4.625032e-10 2.6893096e-10 4.8238413e-10 ] [ 5.1374179e-10 4.5303926e-10 1.415741e-10 ] [ 6.1715081e-10 3.9744454e-10 3.5107317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.56e-05 3.55e-05 3.38e-05 ] [ -1.39e-05 1.95e-05 -3.85e-05 ] [ 3.44e-05 -4.33e-05 2.08e-05 ] [ -1.4e-05 2.84e-05 -3.53e-05 ] [ 9.2e-06 -4.39e-05 -4.5e-06 ] [ -3.77e-05 5.9e-06 3.6e-06 ] [ 6.5e-06 -2.2e-06 2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.499395528448e-14 5.68772700384e-14 5.415356978304e-14 ] [ -2.227025502912e-14 3.12424441056e-14 -6.16837999008e-14 ] [ 5.511487575552001e-14 -6.937424768064e-14 3.332527371264e-14 ] [ -2.24304726912e-14 4.550181603071999e-14 -5.655683471424e-14 ] [ 1.474002491136e-14 -7.033555365312e-14 -7.2097947936e-15 ] [ -6.040205860416e-14 9.45284206272e-15 5.76783583488e-15 ] [ 1.04141480352e-14 -3.52478856576e-15 3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.977958 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.521257048052433e-18 } }