{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5792333 0.1795408 7.3703954 ] [ 1.8524133 0.1406766 -0.0356014 ] [ 3.4989715 -0.44387 -5.8661371 ] [ 4.3348645 -6.3151133 -4.0237048 ] [ -4.9668284 -3.5207394 -1.2902506 ] [ -2.8627562 4.5919738 -0.5680235 ] [ 1.7225687 5.3675315 4.413322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.734563960894711e-09 2.876560746096672e-10 1.180867529322108e-08 ] [ 2.967893305770832e-09 2.253887614705644e-10 -5.703973121768759e-11 ] [ 5.60597038033193e-09 -7.111581425335798e-10 -9.39858779346052e-09 ] [ 6.945218613456092e-09 -1.011792697032263e-08 -6.446685812673642e-09 ] [ -7.957736407567605e-09 -5.640846401083179e-09 -2.06720936332448e-09 ] [ -4.586641092478631e-09 7.357153126300189e-09 -9.100739792628989e-10 ] [ 2.759859321599756e-09 8.59973355155897e-09 7.070921386718148e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.828334 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.016631679194776e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5813991 3.0238105 1.7201197 ] [ 0.3009781 2.3851549 1.8957681 ] [ 2.5578347 4.6123774 3.6686301 ] [ 5.019182 2.4710475 2.2036223 ] [ 3.2589555 2.2000861 3.9967797 ] [ 4.3197865 4.8773743 1.8762764 ] [ 4.9783853 4.0558022 4.1850778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5813991e-10 3.0238105e-10 1.7201197e-10 ] [ 3.009781e-11 2.3851549e-10 1.8957681e-10 ] [ 2.5578347e-10 4.6123774e-10 3.6686301e-10 ] [ 5.019182e-10 2.4710475e-10 2.2036223e-10 ] [ 3.2589555e-10 2.2000861e-10 3.9967797e-10 ] [ 4.3197865e-10 4.877374299999999e-10 1.8762764e-10 ] [ 4.978385300000001e-10 4.0558022e-10 4.1850778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.62e-05 1.87e-05 4.17e-05 ] [ -2.22e-05 -2.84e-05 -3.55e-05 ] [ 9.8e-06 -1.5e-06 -4.5e-06 ] [ -2.26e-05 -2.35e-05 -1.79e-05 ] [ -1.31e-05 1.05e-05 -9.8e-06 ] [ -1.92e-05 3.9e-06 -6.2e-06 ] [ 5.11e-05 2.03e-05 3.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.59552614708e-14 2.99607030558e-14 6.681076563779999e-14 ] [ -3.55683212748e-14 -4.550181640559999e-14 -5.6877270507e-14 ] [ 1.57013310132e-14 -2.403264951e-15 -7.209794853e-15 ] [ -3.62091919284e-14 -3.765115089899999e-14 -2.86789617486e-14 ] [ -2.09885139054e-14 1.6822854657e-14 -1.57013310132e-14 ] [ -3.076179137279999e-14 6.248488872599999e-15 -9.9334951308e-15 ] [ 8.187122599739999e-14 3.252418567019999e-14 5.159008761479998e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.875337 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.825250707027565e-18 } }