{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.500338 2.7906 1.855645 ] [ 0.2759319 4.819421 1.912518 ] [ 2.741561 4.698408 2.586297 ] [ 3.692301 2.569506 2.304209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.500338e-10 2.7906e-10 1.855645e-10 ] [ 2.759319e-11 4.819421e-10 1.912518e-10 ] [ 2.741561e-10 4.698407999999999e-10 2.586297e-10 ] [ 3.692301e-10 2.569506e-10 2.304209e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7731333 -5.1854947 -2.0888756 ] [ -2.4522301 2.2694718 -0.2987726 ] [ 2.0467549 6.1303184 2.0200247 ] [ 5.1786085 -3.2142955 0.3676235 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.647402581221953e-09 -8.308078375622308e-09 -3.346747650079573e-09 ] [ -3.928905735042046e-09 3.636094659524893e-09 -4.786864746556301e-10 ] [ 3.279262849287842e-09 9.821852818540062e-09 3.236436347778534e-09 ] [ 8.297045466976157e-09 -5.149869102442646e-09 5.889977769566688e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3252831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.532044081961349e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1384746 2.2618602 1.6223049 ] [ 0.5592475 4.7178335 1.9982296 ] [ 2.9665864 5.1771031 2.7070505 ] [ 3.5458233 2.7211383 2.331084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1384746e-10 2.2618602e-10 1.6223049e-10 ] [ 5.592475e-11 4.7178335e-10 1.9982296e-10 ] [ 2.9665864e-10 5.1771031e-10 2.7070505e-10 ] [ 3.5458233e-10 2.7211383e-10 2.331084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 3.3e-06 -1.6e-06 ] [ -1.4e-06 6.1e-06 5e-06 ] [ -7.5e-06 -2.8e-06 -6.6e-06 ] [ 1.9e-06 -6.6e-06 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-14 5.28718284864e-15 -2.56348259328e-15 ] [ -2.24304726912e-15 9.77327738688e-15 8.010883104e-15 ] [ -1.2016324656e-14 -4.48609453824e-15 -1.057436569728e-14 ] [ 3.04413557952e-15 -1.057436569728e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6094174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379380727698872e-18 } }