{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.5303241 -13.7044785 -20.6527441 ] [ 0.9260673 -0.5818583 0.3312545 ] [ 33.431935 -16.3311497 0.0947733 ] [ -24.4672569 23.7787622 22.2005369 ] [ 5.6395787 6.8387244 -1.9738206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.488232239146708e-08 -2.195699523385537e-08 -3.308934402500136e-08 ] [ 1.483723389571468e-09 -9.322397725589623e-10 5.30728219807353e-10 ] [ 5.356386508640679e-08 -2.616538645569611e-08 1.518435667870722e-10 ] [ -3.920086730325527e-08 3.809777718228243e-08 3.556918148343479e-08 ] [ 9.035601218744096e-09 1.095684444004567e-08 -3.16240924502786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.0678241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.710842822242079e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1339969 0.2307767 1.3115849 ] [ 0.9250246 2.6464388 1.1769906 ] [ 3.2091649 0.4793038 2.5481647 ] [ 1.1599749 1.5690884 3.3835097 ] [ 3.0001193 2.8949673 2.4136952 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1339969e-10 2.307767e-11 1.3115849e-10 ] [ 9.250246e-11 2.6464388e-10 1.1769906e-10 ] [ 3.2091649e-10 4.793038e-11 2.5481647e-10 ] [ 1.1599749e-10 1.5690884e-10 3.3835097e-10 ] [ 3.0001193e-10 2.8949673e-10 2.4136952e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 -2.87e-05 -2.39e-05 ] [ -3.8e-05 5.19e-05 -1.08e-05 ] [ 3.41e-05 -4.55e-05 3.18e-05 ] [ -1.14e-05 1.7e-06 2.01e-05 ] [ 1.2e-05 2.06e-05 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.4474005556e-15 -4.598246939579999e-14 -3.82920215526e-14 ] [ -6.088271209199999e-14 8.315296730459999e-14 -1.73035076472e-14 ] [ 5.46342232194e-14 -7.289903684699999e-14 5.09492169612e-14 ] [ -1.82648136276e-14 2.7237002778e-15 3.22037503434e-14 ] [ 1.9226119608e-14 3.300483866039999e-14 -2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786281540152e-18 } }