{ "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" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2044476 -2.9467231 1.9854671 ] [ 0.948277 1.1102775 0.6566086 ] [ -6.229972 1.0728981 -1.8084043 ] [ 2.7663224 -4.3699006 -1.5110024 ] [ 2.4317307 3.1456432 -3.3021499 ] [ 1.2880896 1.987805 3.9794808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92973778569867e-09 -4.721170858791301e-09 3.181068968987576e-09 ] [ 1.519307239442362e-09 1.778860653100272e-09 1.052002947936219e-09 ] [ -9.981515486638618e-09 1.71897225232074e-09 -2.89738309041419e-09 ] [ 4.432137074875346e-09 -7.001352576539893e-09 -2.42089271925269e-09 ] [ 3.896062075621619e-09 5.039875992418498e-09 -5.290627368157058e-09 ] [ 2.063747042615624e-09 3.184814697709344e-09 6.375831100682481e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.465965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.676832443711107e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5512108 2.2116913 5.7011442 ] [ 1.7866045 1.703314 3.5144315 ] [ 1.2866558 3.9676931 2.7200797 ] [ 3.8837601 1.9758355 2.2750707 ] [ 3.7019576 4.3326048 2.9238559 ] [ 3.9374789 4.1146702 5.2737081 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5512108e-10 2.2116913e-10 5.701144200000001e-10 ] [ 1.7866045e-10 1.703314e-10 3.514431500000001e-10 ] [ 1.2866558e-10 3.9676931e-10 2.7200797e-10 ] [ 3.8837601e-10 1.9758355e-10 2.2750707e-10 ] [ 3.7019576e-10 4.3326048e-10 2.9238559e-10 ] [ 3.9374789e-10 4.1146702e-10 5.273708100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.77e-05 -1.47e-05 -4e-06 ] [ -1.43e-05 -1.56e-05 3.72e-05 ] [ 8.2e-06 1.96e-05 4.07e-05 ] [ 3.88e-05 -3.34e-05 -9.9e-06 ] [ 2.22e-05 6.26e-05 -4.23e-05 ] [ -3.71e-05 -1.85e-05 -2.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835852618816e-14 -2.355199632576e-14 -6.4087064832e-15 ] [ -2.291112567744e-14 -2.499395528448e-14 5.960097029376001e-14 ] [ 1.313784829056e-14 3.140266176767999e-14 6.520858846656e-14 ] [ 6.216445288704e-14 -5.351269913472e-14 -1.586154854592e-14 ] [ 3.556832098176e-14 1.0029625646208e-13 -6.777207105984e-14 ] [ -5.944075263168e-14 -2.96402674848e-14 -3.460701500928e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }