{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5787709 -1.6599157 0.3147675 ] [ -2.6761538 0.8443681 -2.0773712 ] [ -1.4910093 3.1048726 3.6751097 ] [ 5.2250102 -5.6440439 -6.1993216 ] [ 1.5322594 -1.4274505 9.822053 ] [ -0.0113357 4.7821694 -5.5352375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.131646446379375e-09 -2.659478127038866e-09 5.04313129487664e-10 ] [ -4.287671052025079e-09 1.352826829169316e-09 -3.328315569363241e-09 ] [ -2.388860241855373e-09 4.974554290282511e-09 5.888174840215302e-09 ] [ 8.371389185881532e-09 -9.042755183348853e-09 -9.93240813234045e-09 ] [ 2.454950187681036e-09 -2.28702781844927e-09 1.57366636848585e-08 ] [ -1.816179352040256e-11 7.661880009385164e-09 -8.86842811307544e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.059542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.611716300835567e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0861553 0.3860782 2.0865462 ] [ -0.083408 1.8141275 0.1665364 ] [ 2.0146632 3.3295912 2.7877719 ] [ 3.3920774 0.9197194 0.9973134 ] [ 2.0285966 0.8908469 3.0340749 ] [ 2.0323714 2.8639546 0.3812735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.615530000000001e-12 3.860782e-11 2.0865462e-10 ] [ -8.3408e-12 1.8141275e-10 1.665364e-11 ] [ 2.0146632e-10 3.3295912e-10 2.7877719e-10 ] [ 3.3920774e-10 9.197194e-11 9.973134e-11 ] [ 2.0285966e-10 8.908469e-11 3.0340749e-10 ] [ 2.0323714e-10 2.8639546e-10 3.812735e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.02e-05 4.57e-05 -2.17e-05 ] [ -3.83e-05 2.53e-05 -8.2e-06 ] [ -3.76e-05 2.74e-05 -8e-07 ] [ 5.38e-05 -2.12e-05 -3.42e-05 ] [ -1.1e-06 -6.4e-05 8.75e-05 ] [ -1.7e-05 -1.33e-05 -2.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.440750015616e-14 7.321947157056e-14 -3.476723267136e-14 ] [ -6.136336457664001e-14 4.053506850624e-14 -1.313784829056e-14 ] [ -6.024184094208e-14 4.389963940992e-14 -1.28174129664e-15 ] [ 8.619710219904001e-14 -3.396614436096001e-14 -5.479444043136e-14 ] [ -1.76239428288e-15 -1.025393037312e-13 1.4019045432e-13 ] [ -2.72370025536e-14 -2.130894905664e-14 -3.620919163008e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }