{ "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" [ [ 3.1268812 -8.3303243 0.6965757 ] [ -6.5956127 6.3228485 1.099433 ] [ 12.1903533 -13.9064367 0.0120505 ] [ -10.1101698 -2.2450322 -9.2195652 ] [ -0.5236971 0.3175565 6.5290216 ] [ 1.9122451 17.8413883 0.8824845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.00981599593388e-09 -1.33466509471024e-08 1.116037310352194e-09 ] [ -1.056733655485365e-08 1.013032012702195e-08 1.761485863248522e-09 ] [ 1.953109921746479e-08 -2.228056794294007e-08 1.9307029528017e-11 ] [ -1.619827781933245e-08 -3.596938133417614e-09 -1.477137193907954e-08 ] [ -8.390552569135613e-10 5.08781604274821e-10 1.046064585040129e-08 ] [ 3.063754417700993e-09 2.858505545238098e-08 1.413896045767173e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7246957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.569797053300273e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.056488 0.7951795 3.8649037 ] [ 1.5533055 2.9049625 4.1634046 ] [ 5.3011443 1.7827743 2.977694 ] [ 2.9826018 2.7689836 2.0423149 ] [ 3.9898431 3.0774968 4.9340572 ] [ 4.8246503 4.3442773 2.8703806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.056488e-10 7.951795e-11 3.8649037e-10 ] [ 1.5533055e-10 2.9049625e-10 4.1634046e-10 ] [ 5.3011443e-10 1.7827743e-10 2.977694e-10 ] [ 2.9826018e-10 2.7689836e-10 2.0423149e-10 ] [ 3.9898431e-10 3.0774968e-10 4.9340572e-10 ] [ 4.8246503e-10 4.3442773e-10 2.8703806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 8.2e-06 7.6e-06 ] [ 5.9e-06 4.2e-06 -9.1e-06 ] [ 1.25e-05 6.9e-06 -7.9e-06 ] [ -9.5e-06 -1.4e-06 1.04e-05 ] [ -7.5e-06 -6.2e-06 -9.8e-06 ] [ -1.7e-06 -1.17e-05 8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-16 1.31378483988e-14 1.21765424184e-14 ] [ 9.452842140600001e-15 6.729141862799999e-15 -1.45798073694e-14 ] [ 2.0027207925e-14 1.10550187746e-14 -1.26571954086e-14 ] [ -1.5220678023e-14 -2.2430472876e-15 1.66626369936e-14 ] [ -1.2016324755e-14 -9.9334951308e-15 -1.57013310132e-14 ] [ -2.7237002778e-15 -1.87454666178e-14 1.42593720426e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.220528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.118162105074275e-18 } }