{ "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" [ [ 0.142629 1.3142049 0.3978339 ] [ -5.1359528 -0.8213591 -0.9145865 ] [ -2.3778164 -1.3592577 -2.8372688 ] [ 1.3747558 -2.172443 -6.4257272 ] [ 4.0947381 -0.3549379 8.6917849 ] [ 1.9016463 3.3937928 1.0879637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.285168492480832e-10 2.105588365720802e-09 6.374001735416852e-10 ] [ -8.2287035016923e-09 -1.315962347301329e-09 -1.465329107999299e-09 ] [ -3.809681844634822e-09 -2.17777090858238e-09 -4.54580573828527e-09 ] [ 2.202601602069201e-09 -3.480637384620614e-09 -1.029514989147865e-08 ] [ 6.560493652119012e-09 -5.686732052158483e-10 1.392577455980247e-08 ] [ 3.046773242890823e-09 5.437455479999371e-09 1.743110004419065e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.495695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.642901687284746e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0117652 -0.0285173 0.7166007 ] [ 0.3527171 1.6553251 2.3949109 ] [ 1.0966574 2.372171 0.1545834 ] [ 3.1894619 1.0977625 0.4417636 ] [ 2.4455171 0.3809123 2.6820875 ] [ 2.5304124 2.7816026 2.120068 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0117652e-10 -2.85173e-12 7.166007e-11 ] [ 3.527171e-11 1.6553251e-10 2.3949109e-10 ] [ 1.0966574e-10 2.372171e-10 1.545834e-11 ] [ 3.1894619e-10 1.0977625e-10 4.417636e-11 ] [ 2.4455171e-10 3.809123e-11 2.6820875e-10 ] [ 2.5304124e-10 2.7816026e-10 2.120068e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.39e-05 4.9e-06 2.2e-05 ] [ 2.35e-05 -1.06e-05 2.1e-06 ] [ 3.7e-05 -1.1e-06 1.76e-05 ] [ -2.72e-05 3e-07 -1.63e-05 ] [ -3.33e-05 2.9e-06 -1.56e-05 ] [ -2.38e-05 3.7e-06 -9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.829202123712e-14 7.850665441919999e-15 3.52478856576e-14 ] [ 3.76511505888e-14 -1.698307218048e-14 3.36457090368e-15 ] [ 5.92805349696e-14 -1.76239428288e-15 2.819830852608e-14 ] [ -4.357920408576e-14 4.8065298624e-16 -2.611547891904e-14 ] [ -5.335248147264001e-14 4.646312200320001e-15 -2.499395528448e-14 ] [ -3.813180357504e-14 5.928053496960001e-15 -1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }