{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0501002 -3.079444 -5.5373718 ] [ -3.3723914 -3.8626801 4.0843447 ] [ -5.1379989 2.9483713 -2.6823769 ] [ 3.4189327 7.9463839 1.7290738 ] [ 3.0413574 -3.9526311 2.4063302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.284622610737405e-09 -4.933813181862836e-09 -8.871847638637212e-09 ] [ -5.403166657266982e-09 -6.188695749849406e-09 6.543841589628389e-09 ] [ -8.231981715276118e-09 4.723811566297702e-09 -4.297641557353979e-09 ] [ 5.477734040028621e-09 1.273151050448152e-08 2.770281617997815e-09 ] [ 4.872791721777074e-09 -6.332813139066987e-09 3.855365988364989e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.829277 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.094170794636716e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4154958 0.9737497 1.1060048 ] [ 0.8343297 1.4290251 2.9872921 ] [ 0.6151223 3.6903218 2.1654101 ] [ 2.7877647 4.2534279 2.9953816 ] [ 3.3205255 1.9219205 3.2491224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4154958e-10 9.737497000000001e-11 1.1060048e-10 ] [ 8.343297e-11 1.4290251e-10 2.9872921e-10 ] [ 6.151223e-11 3.6903218e-10 2.1654101e-10 ] [ 2.7877647e-10 4.2534279e-10 2.9953816e-10 ] [ 3.3205255e-10 1.9219205e-10 3.2491224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.07e-05 -4.1e-06 7.24e-05 ] [ 3.06e-05 3.58e-05 -4.88e-05 ] [ 4.41e-05 -4.84e-05 2.77e-05 ] [ -1.6e-05 1.86e-05 1.83e-05 ] [ -4.8e-05 -1.9e-06 -6.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714328984256e-14 -6.568924145279999e-15 1.1599758734592e-13 ] [ 4.902660459647999e-14 5.735792302464001e-14 -7.818621909504e-14 ] [ 7.065598897728e-14 -7.754534844671999e-14 4.438029239616e-14 ] [ -2.56348259328e-14 2.980048514688e-14 2.931983216064e-14 ] [ -7.69044777984e-14 -3.04413557952e-15 -1.1151149280768e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.984283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.759876141885089e-18 } }