{ "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" [ [ -7.1659427 -5.1023188 -15.2620699 ] [ -12.5185567 -8.9099792 7.5560102 ] [ -7.5055956 10.5480138 -0.2137242 ] [ 18.3665083 -12.481707 1.3628665 ] [ 6.842019 6.8097164 -8.2431887 ] [ 1.9815677 9.1362748 14.8001061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.148110585993243e-08 -8.17481589322831e-09 -2.445253157879539e-08 ] [ -2.00569388708992e-08 -1.427536036605429e-08 1.210606288896633e-08 ] [ -1.202528979549935e-08 1.689978110623577e-08 -3.424239165391834e-10 ] [ 2.942639020398915e-08 -1.999789914307571e-08 2.183552843571523e-09 ] [ 1.09621228808694e-08 1.091036841035834e-08 -1.320704421598274e-08 ] [ 3.174821441472428e-09 1.46379258857642e-08 2.371238397877947e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.8077433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.090720715566784e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4487958 0.3551289 -0.0757566 ] [ -0.1215522 0.0971875 2.2003159 ] [ 0.9960178 3.4523911 1.6364152 ] [ 3.3105983 1.0876652 1.9485228 ] [ 2.1238731 2.009996 0.0406085 ] [ 1.3247365 1.6486843 3.2294473 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.487958e-11 3.551289e-11 -7.57566e-12 ] [ -1.215522e-11 9.71875e-12 2.2003159e-10 ] [ 9.960178e-11 3.4523911e-10 1.6364152e-10 ] [ 3.3105983e-10 1.0876652e-10 1.9485228e-10 ] [ 2.1238731e-10 2.009996e-10 4.06085e-12 ] [ 1.3247365e-10 1.6486843e-10 3.2294473e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -3.07e-05 -7.6e-06 ] [ -5.9e-06 2.51e-05 -1.86e-05 ] [ 1.42e-05 -1.1e-05 1.1e-05 ] [ 2.8e-06 1.09e-05 3.1e-06 ] [ -2.65e-05 4.6e-06 2.15e-05 ] [ 1.2e-05 1.1e-06 -9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -4.918682225856e-14 -1.217654231808e-14 ] [ -9.45284206272e-15 4.021463318208e-14 -2.980048514688e-14 ] [ 2.275090801536e-14 -1.76239428288e-14 1.76239428288e-14 ] [ 4.48609453824e-15 1.746372516672e-14 4.96674752448e-15 ] [ -4.24576804512e-14 7.370012455680001e-15 3.44467973472e-14 ] [ 1.92261194496e-14 1.76239428288e-15 -1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }