{ "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" [ [ 0.3142934 0.7540522 2.32218 ] [ 0.538251 2.820956 1.392978 ] [ 2.532298 0.1763292 2.432177 ] [ 1.796653 2.418536 0.8624239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.142934e-11 7.540522e-11 2.32218e-10 ] [ 5.38251e-11 2.820956e-10 1.392978e-10 ] [ 2.532298e-10 1.763292e-11 2.432177e-10 ] [ 1.796653e-10 2.418536e-10 8.624239e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.9827011 10.775133 -0.9113924 ] [ -1937.8550096 606.3915655 822.1011736 ] [ 14.1506273 3.2924861 -4.5821088 ] [ 1944.6870833 -620.4591846 -816.6076725 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.361799314365444e-08 1.726366617861057e-08 -1.460211595654802e-09 ] [ -3.104785990881279e-06 9.715463892944117e-07 1.317151280274162e-06 ] [ 2.267180422971423e-08 5.275144253728971e-09 -7.341347593321944e-09 ] [ 3.115732179635002e-06 -9.940851997267514e-07 -1.308349721245403e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 436.01126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.985670471775503e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0508601 0.6674832 2.6980595 ] [ 0.1099054 2.835014 1.3882601 ] [ 2.4808041 0.2498562 2.1165067 ] [ 2.5399257 2.41752 0.8069325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.08601e-12 6.674832e-11 2.6980595e-10 ] [ 1.099054e-11 2.835014e-10 1.3882601e-10 ] [ 2.4808041e-10 2.498562e-11 2.1165067e-10 ] [ 2.5399257e-10 2.41752e-10 8.069325000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.38e-05 2.28e-05 -4.47e-05 ] [ 2.21e-05 -3.3e-05 3.84e-05 ] [ -1.65e-05 4.41e-05 5.8e-06 ] [ -1.95e-05 -3.39e-05 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.211003736704e-14 3.652962695424e-14 -7.161729494976001e-14 ] [ 3.540810331968e-14 -5.28718284864e-14 6.152358223872e-14 ] [ -2.64359142432e-14 7.065598897728e-14 9.292624400640001e-15 ] [ -3.12424441056e-14 -5.431378744512e-14 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.481807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999805936073779e-18 } }