{ "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" [ [ 0.7988983 0.4673865 0.2218489 ] [ 0.3258309 0.1815657 2.151485 ] [ 0.290514 2.993692 1.621534 ] [ 2.152844 0.6900228 1.637351 ] [ 2.682916 2.279137 0.4360972 ] [ 1.831466 2.039249 2.911237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.988983e-11 4.673865e-11 2.218489e-11 ] [ 3.258309e-11 1.815657e-11 2.151485e-10 ] [ 2.90514e-11 2.993692e-10 1.621534e-10 ] [ 2.152844e-10 6.900228e-11 1.637351e-10 ] [ 2.682916e-10 2.279137e-10 4.360972e-11 ] [ 1.831466e-10 2.039249e-10 2.911237e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.4251918 -15.9390925 -33.3064462 ] [ -25.8182814 -22.3613007 13.9698355 ] [ -20.9817425 30.9836816 1.2320063 ] [ 38.4589102 -27.3052737 3.7983212 ] [ 18.7356304 14.9775898 -20.1962175 ] [ 6.030675 19.6443955 34.5025007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.631605829411587e-08 -2.553724136026862e-08 -5.336280942357301e-08 ] [ -4.136544684831549e-08 -3.582675319221867e-08 2.238214383452188e-08 ] [ -3.361645729714575e-08 4.964133028583114e-08 1.973891690538311e-09 ] [ 6.161796678388665e-08 -4.374787114668511e-08 6.085581424929001e-09 ] [ 3.001778900282976e-08 2.399674421349255e-08 -3.235790750709182e-08 ] [ 9.66220649264304e-09 3.147379119984873e-08 5.527909998067563e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 29.575858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.738574822770065e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4612095 0.3209718 -0.1033472 ] [ -0.1326845 0.0567336 2.1984981 ] [ 0.9559675 3.503914 1.6323621 ] [ 3.3662701 1.1044379 1.9788676 ] [ 2.1365888 2.0196581 0.0059791 ] [ 1.2951178 1.6453376 3.2671933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.612095e-11 3.209718e-11 -1.033472e-11 ] [ -1.326845e-11 5.673360000000001e-12 2.1984981e-10 ] [ 9.559675e-11 3.503914e-10 1.6323621e-10 ] [ 3.3662701e-10 1.1044379e-10 1.9788676e-10 ] [ 2.1365888e-10 2.0196581e-10 5.9791e-13 ] [ 1.2951178e-10 1.6453376e-10 3.2671933e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.94e-05 -1.53e-05 2.75e-05 ] [ -2.29e-05 2.54e-05 2.1e-06 ] [ 3.42e-05 -1.18e-05 1.55e-05 ] [ -5.25e-05 4.75e-05 -2.25e-05 ] [ -2.17e-05 -1.28e-05 6.14e-05 ] [ 2.34e-05 -3.3e-05 -8.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.312575885952001e-14 -2.451330229824e-14 4.4059857072e-14 ] [ -3.668984461632e-14 4.069528616832e-14 3.36457090368e-15 ] [ 5.479444043136e-14 -1.890568412544e-14 2.48337376224e-14 ] [ -8.4114272592e-14 7.610338948800001e-14 -3.604897396800001e-14 ] [ -3.476723267136e-14 -2.050786074624e-14 9.837364451712e-14 ] [ 3.749093292672001e-14 -5.28718284864e-14 -1.345828361472e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }