{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.4205559 -1.5443294 -1.7085768 ] [ -21.889118 -14.6601551 17.6568238 ] [ 6.3157667 -10.41854 -5.4014955 ] [ -17.1351561 25.2241828 -38.6908304 ] [ 45.1290633 1.3988416 28.1440789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.98999242803195e-08 -2.474288459494092e-09 -2.737441803801277e-09 ] [ -3.507023310953246e-08 -2.348815775852189e-08 2.828935028994502e-08 ] [ 1.011897374916717e-08 -1.669234121086963e-08 -8.654149807456407e-09 ] [ -2.745354649717851e-08 4.041359596094549e-08 -6.198954390621792e-08 ] [ 7.230473013786329e-08 2.241191307722465e-09 4.509178522753058e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.7537934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.218593266393343e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3530019 1.1127212 0.6316511 ] [ 1.0765991 1.1193473 3.1189889 ] [ 2.5994613 -0.0777834 0.1350191 ] [ 1.6532569 3.3412853 0.4011637 ] [ 3.1998617 1.8092341 1.8051079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.530019e-11 1.1127212e-10 6.316511000000001e-11 ] [ 1.0765991e-10 1.1193473e-10 3.1189889e-10 ] [ 2.5994613e-10 -7.778340000000001e-12 1.350191e-11 ] [ 1.6532569e-10 3.3412853e-10 4.011637e-11 ] [ 3.1998617e-10 1.8092341e-10 1.8051079e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.01e-05 8.3e-06 4e-05 ] [ -1.96e-05 -9.7e-06 2.07e-05 ] [ -4.2e-06 -1.13e-05 -1.24e-05 ] [ -3.67e-05 6.54e-05 -5.01e-05 ] [ -2.96e-05 -5.27e-05 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4435611353408e-13 1.329806595264e-14 6.4087064832e-14 ] [ -3.140266176767999e-14 -1.554111322176e-14 3.316505605055999e-14 ] [ -6.72914180736e-15 -1.810459581504e-14 -1.986699009792e-14 ] [ -5.879988198335999e-14 1.0478235100032e-13 -8.026904870208e-14 ] [ -4.742442797568e-14 -8.443470791616e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }