{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2934339 -3.1886834 8.4861252 ] [ -7.0158733 2.2137099 4.407883 ] [ 8.3998634 -21.6507967 6.6563384 ] [ 68.0440698 11.0538762 18.5935262 ] [ -63.1346261 11.571894 -38.1438728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.008319265913017e-08 -5.108833994613055e-09 1.359627139662173e-08 ] [ -1.124066817575494e-08 3.546754247013506e-09 7.062207089821766e-09 ] [ 1.34580647573936e-08 -3.46884002944338e-08 1.066462976461328e-08 ] [ 1.090186178176433e-07 1.771026201685755e-08 2.979011297587227e-08 ] [ -1.011528219003695e-07 1.85402180251758e-08 -6.111322122692903e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.20533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.756597747914887e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0663726 0.3911098 3.0340473 ] [ -0.0765276 1.9924084 1.9580357 ] [ 3.0719955 0.1918362 2.0512232 ] [ 3.1686407 1.6699817 0.3677977 ] [ 1.2227418 2.7827857 0.3101954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0663726e-10 3.911098e-11 3.0340473e-10 ] [ -7.652760000000001e-12 1.9924084e-10 1.9580357e-10 ] [ 3.0719955e-10 1.918362e-11 2.0512232e-10 ] [ 3.1686407e-10 1.6699817e-10 3.677977e-11 ] [ 1.2227418e-10 2.7827857e-10 3.101954e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 1.4e-06 1.2e-06 ] [ -1.3e-06 -4.4e-06 5e-06 ] [ 1.7e-06 -2e-06 1.7e-06 ] [ 8.7e-06 -2.2e-06 -3.7e-06 ] [ -4.7e-06 7.2e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.04957713152e-15 2.24304726912e-15 1.92261194496e-15 ] [ -2.08282960704e-15 -7.04957713152e-15 8.010883104e-15 ] [ 2.72370025536e-15 -3.2043532416e-15 2.72370025536e-15 ] [ 1.393893660096e-14 -3.52478856576e-15 -5.928053496960001e-15 ] [ -7.53023011776e-15 1.153567166976e-14 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }