{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.237978 1.1964025 0.3352364 ] [ -2.571663 0.5212993 1.5846946 ] [ 0.3485807 -0.3424932 -0.2180379 ] [ 2.7345901 -0.5259247 -1.3871408 ] [ -0.7494858 -0.8492839 -0.3147522 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.812827878647424e-10 1.916848114566672e-09 5.371079225211571e-10 ] [ -4.12025833517639e-09 8.352135508994055e-10 2.538960639228008e-09 ] [ 5.584878480020986e-10 -5.487345978229785e-10 -3.493352258283283e-10 ] [ 4.381296325691134e-09 -8.426242586412539e-10 -2.222444559517809e-09 ] [ -1.200808626381585e-09 -1.360702809001845e-09 -5.042886161853657e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.960178399234948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.344905245451403e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3600587 0.4098888 2.378573 ] [ 1.6965472 2.6864632 2.4175296 ] [ 2.7316607 3.6718618 0.5658982 ] [ 3.9641588 1.8990978 1.4654949 ] [ 3.4641335 1.8904832 3.7837833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3600587e-10 4.098888e-11 2.378573e-10 ] [ 1.6965472e-10 2.6864632e-10 2.4175296e-10 ] [ 2.7316607e-10 3.6718618e-10 5.658982e-11 ] [ 3.9641588e-10 1.8990978e-10 1.4654949e-10 ] [ 3.4641335e-10 1.8904832e-10 3.7837833e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-05 -5.77e-05 1.98e-05 ] [ -3.3e-06 1.18e-05 7.9e-06 ] [ 1.4e-05 5.96e-05 -4.09e-05 ] [ -2.06e-05 -1.34e-05 -2.98e-05 ] [ -1.01e-05 -4e-07 4.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-14 -9.244559102016e-14 3.172309709184e-14 ] [ -5.28718284864e-15 1.890568412544e-14 1.265719530432e-14 ] [ 2.24304726912e-14 9.548972659968001e-14 -6.552902379072e-14 ] [ -3.300483838848e-14 -2.146916671872e-14 -4.774486329984001e-14 ] [ -1.618198387008e-14 -6.408706483200001e-16 6.889359469439999e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.057896399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.103643361282738e-19 } }