{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8962228 -6.7029824 1.3303162 ] [ -2.3210117 5.1200759 0.8168333 ] [ 10.5712709 -10.234375 -0.6685895 ] [ -7.7044929 -1.6243424 -8.0491987 ] [ -1.2377789 0.3161163 5.3721042 ] [ -0.2042102 13.1255076 1.1985345 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.435907217187914e-09 -1.073936169091387e-08 2.131401513911497e-09 ] [ -3.718670682343264e-09 8.203265903701519e-09 1.308711216350913e-09 ] [ 1.693704308812337e-08 -1.63972763535e-08 -1.071198465812362e-09 ] [ -1.234395839949959e-08 -2.602483417454162e-09 -1.289623797331375e-08 ] [ -1.983140415299541e-09 5.064741453137991e-10 8.607059753741487e-09 ] [ -3.271808081688922e-10 2.102938141285272e-08 1.920263955122218e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.846544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.218460907567852e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0168798 0.9489423 3.8607143 ] [ 2.0213261 3.3046022 3.9732333 ] [ 5.2146871 1.9199616 2.9776926 ] [ 3.0132445 2.4377462 1.7783241 ] [ 4.2227718 2.7868034 5.1725931 ] [ 4.2191235 4.2756182 3.0901975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0168798e-10 9.489423000000001e-11 3.860714300000001e-10 ] [ 2.0213261e-10 3.3046022e-10 3.9732333e-10 ] [ 5.2146871e-10 1.9199616e-10 2.9776926e-10 ] [ 3.0132445e-10 2.4377462e-10 1.7783241e-10 ] [ 4.222771800000001e-10 2.7868034e-10 5.172593100000001e-10 ] [ 4.2191235e-10 4.275618200000001e-10 3.0901975e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.07e-05 -4.9e-05 2.48e-05 ] [ 4.3e-06 1.05e-05 -1.88e-05 ] [ 2.84e-05 -4.3e-05 -2.99e-05 ] [ -2.6e-05 2.68e-05 -2.77e-05 ] [ -1.32e-05 2.88e-05 3.75e-05 ] [ -4.2e-06 2.58e-05 1.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.714328984256e-14 -7.85066544192e-14 3.973398019584e-14 ] [ 6.889359469440001e-15 1.68228545184e-14 -3.012092047104e-14 ] [ 4.550181603071999e-14 -6.889359469439999e-14 -4.790508096192e-14 ] [ -4.16565921408e-14 4.293833343744e-14 -4.438029239616e-14 ] [ -2.114873139456e-14 4.614268667904e-14 6.008162327999999e-14 ] [ -6.72914180736e-15 4.133615681664e-14 2.259069035328e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.222449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.239993500312034e-18 } }