{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.0019023 -11.050668 -11.1783401 ] [ -3.0958349 -7.7112083 11.920685 ] [ 7.0931859 14.6528722 -8.4447039 ] [ -4.7791371 8.426487 8.2591314 ] [ 5.8101536 -5.9604219 -3.5857659 ] [ 3.9735348 1.6429389 3.0289936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.442263740778575e-08 -1.770512191382269e-08 -1.790967516757113e-08 ] [ -4.960074298636705e-09 -1.235471765637891e-08 1.909904281092125e-08 ] [ 1.136453661596821e-08 2.347648926641026e-08 -1.352990715815858e-08 ] [ -7.65702172921791e-09 1.350072046687513e-08 1.323258723719517e-08 ] [ 9.308892261176954e-09 -9.549648618284316e-09 -5.745030292641871e-09 ] [ 6.366304558495204e-09 2.632278294982869e-09 4.852982730472827e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7764803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.84623520397177e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2445354 0.5812977 0.805383 ] [ -0.473865 0.6456471 3.0243567 ] [ 0.4131341 2.9080658 0.7628522 ] [ 0.6492589 2.6902066 3.073884 ] [ 2.4495483 0.1950565 1.2838401 ] [ 2.7577712 1.8011263 3.011452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.445354e-11 5.812977000000001e-11 8.05383e-11 ] [ -4.73865e-11 6.456471e-11 3.0243567e-10 ] [ 4.131341e-11 2.9080658e-10 7.628522e-11 ] [ 6.492589e-11 2.6902066e-10 3.073884e-10 ] [ 2.4495483e-10 1.950565e-11 1.2838401e-10 ] [ 2.7577712e-10 1.8011263e-10 3.011452e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 -4.3e-06 -6e-07 ] [ -3.8e-06 -1.1e-06 1e-06 ] [ 3.2e-06 2e-07 9e-07 ] [ 3.7e-06 5e-07 2.5e-06 ] [ -3e-06 8e-07 -3e-06 ] [ -3e-06 3.8e-06 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.646312200320001e-15 -6.889359469440001e-15 -9.6130597248e-16 ] [ -6.08827115904e-15 -1.76239428288e-15 1.6021766208e-15 ] [ 5.126965186560001e-15 3.2043532416e-16 1.44195895872e-15 ] [ 5.928053496960001e-15 8.010883104e-16 4.005441552e-15 ] [ -4.8065298624e-15 1.28174129664e-15 -4.8065298624e-15 ] [ -4.8065298624e-15 6.08827115904e-15 -1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.181251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.272086880589662e-18 } }