{ "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" [ [ 0.7266937 0.3281129 0.1138198 ] [ 0.6755994 0.7068783 2.528749 ] [ 1.24494 2.902842 0.1722514 ] [ 2.894919 0.4231749 1.051303 ] [ 2.63173 1.048668 2.819948 ] [ 2.452649 2.84958 1.823943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.266937e-11 3.281129e-11 1.138198e-11 ] [ 6.755994e-11 7.068783e-11 2.528749e-10 ] [ 1.24494e-10 2.902842e-10 1.722514e-11 ] [ 2.894919e-10 4.231749e-11 1.051303e-10 ] [ 2.63173e-10 1.048668e-10 2.819948e-10 ] [ 2.452649e-10 2.84958e-10 1.823943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5100901 1.578608 -0.3523062 ] [ -8.729953 -3.3530638 -0.6148015 ] [ -3.757339 -1.6248461 -4.60018 ] [ 2.4497165 -4.5199986 -12.0285029 ] [ 5.8406836 0.7367618 16.2693401 ] [ 4.706982 7.1825387 1.3264506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.172544327215342e-10 2.529208831007847e-09 -5.644567570028891e-10 ] [ -1.398692659728282e-08 -5.372200428410807e-09 -9.850205897327712e-10 ] [ -6.019920702220051e-09 -2.603290433818059e-09 -7.370300847471744e-09 ] [ 3.924878503888003e-09 -7.241836082968731e-09 -1.9271786129605e-08 ] [ 9.35780671340998e-09 1.180422531058525e-09 2.606635634406394e-08 ] [ 7.541416514926426e-09 1.150769558313123e-08 2.125208139966133e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.664598 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.868874620663044e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7004979 0.5493565 0.2422466 ] [ 0.4336807 0.2548455 2.5330869 ] [ 1.1018244 2.8356722 0.1096834 ] [ 2.9858829 0.571612 0.8960379 ] [ 2.4787384 1.1602426 3.1754342 ] [ 2.9259067 2.8875272 1.5535253 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.004979e-11 5.493565e-11 2.422466e-11 ] [ 4.336807e-11 2.548455e-11 2.5330869e-10 ] [ 1.1018244e-10 2.8356722e-10 1.096834e-11 ] [ 2.9858829e-10 5.71612e-11 8.960379000000001e-11 ] [ 2.4787384e-10 1.1602426e-10 3.175434200000001e-10 ] [ 2.9259067e-10 2.8875272e-10 1.5535253e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.69e-05 3.3e-06 8.5e-06 ] [ 4.39e-05 -2.1e-06 -5.27e-05 ] [ 4.43e-05 -2.23e-05 3.3e-05 ] [ -9.65e-05 3.55e-05 3.25e-05 ] [ 1.33e-05 -4.9e-06 2.75e-05 ] [ -2.2e-05 -9.4e-06 -4.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.707678489152e-14 5.28718284864e-15 1.36185012768e-14 ] [ 7.033555365312e-14 -3.36457090368e-15 -8.443470791616e-14 ] [ 7.097642430144e-14 -3.572853864384e-14 5.28718284864e-14 ] [ -1.546100439072e-13 5.68772700384e-14 5.207074017599999e-14 ] [ 2.130894905664e-14 -7.850665441919999e-15 4.4059857072e-14 ] [ -3.52478856576e-14 -1.506046023552e-14 -7.818621909504e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.074191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.895804626007377e-18 } }