{ "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" [ [ 0.9949033 2.503274 2.364783 ] [ 2.081862 1.922853 4.128948 ] [ 3.003732 4.725891 2.729897 ] [ 1.175643 3.973335 4.072515 ] [ 3.741462 2.310355 2.499434 ] [ 3.610675 3.096222 4.683717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.949033000000001e-11 2.503274000000001e-10 2.364783e-10 ] [ 2.081862e-10 1.922853e-10 4.128948e-10 ] [ 3.003732e-10 4.725891e-10 2.729897e-10 ] [ 1.175643e-10 3.973335e-10 4.072515e-10 ] [ 3.741462e-10 2.310355e-10 2.499434e-10 ] [ 3.610675e-10 3.096222e-10 4.683717e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8073073 2.2418191 -3.9597304 ] [ -4.4567037 -7.8115167 1.2171523 ] [ -1.1576581 -4.4098624 1.1512114 ] [ 1.3742806 1.3810334 0.9116936 ] [ -2.7100757 1.638861 0.3413931 ] [ 5.1428495 6.9596657 0.33828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.895625502661172e-09 3.591790150082897e-09 -6.344187471551033e-09 ] [ -7.140426473972857e-09 -1.251542942972877e-08 1.950092959012948e-09 ] [ -1.854772742699748e-09 -7.065378438224978e-09 1.844443990678437e-09 ] [ 2.201840247738997e-09 2.212659426023935e-09 1.460694171252987e-09 ] [ -4.342019927138194e-09 2.625744778940908e-09 5.469720433224364e-10 ] [ 8.23975323319297e-09 1.115061367312367e-08 5.419843072842241e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.257284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.726227668810591e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3045588 2.7909821 2.2159414 ] [ 1.9889936 1.6731462 4.1858751 ] [ 2.8804308 4.504163 2.6405552 ] [ 1.2843139 3.9295241 4.2900592 ] [ 3.5851122 2.2477868 2.5363732 ] [ 3.5648681 3.3863277 4.61049 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3045588e-10 2.7909821e-10 2.2159414e-10 ] [ 1.9889936e-10 1.6731462e-10 4.1858751e-10 ] [ 2.8804308e-10 4.504163e-10 2.6405552e-10 ] [ 1.2843139e-10 3.9295241e-10 4.2900592e-10 ] [ 3.5851122e-10 2.2477868e-10 2.5363732e-10 ] [ 3.5648681e-10 3.3863277e-10 4.610490000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.34e-05 8e-07 -4.02e-05 ] [ 1.75e-05 1.77e-05 2.23e-05 ] [ -2.3e-06 3.3e-06 -7.4e-06 ] [ 1.78e-05 -1.03e-05 1.12e-05 ] [ -5.4e-06 -1e-05 -2.15e-05 ] [ -1.41e-05 -1.5e-06 3.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146916671872e-14 1.28174129664e-15 -6.440750015616e-14 ] [ 2.8038090864e-14 2.835852618816e-14 3.572853864384e-14 ] [ -3.68500622784e-15 5.28718284864e-15 -1.185610699392e-14 ] [ 2.851874385024e-14 -1.650241919424e-14 1.794437815296e-14 ] [ -8.65175375232e-15 -1.6021766208e-14 -3.44467973472e-14 ] [ -2.259069035328e-14 -2.4032649312e-15 5.703748770048e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964547696158e-18 } }