{ "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" [ [ -5.7670488 -1.0203665 -5.2116349 ] [ -9.3290166 -8.403098 12.3982952 ] [ 0.6647948 -4.843639 -1.5774603 ] [ -8.2687058 11.9625312 -17.6392345 ] [ 22.6999764 2.3045722 12.0300345 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.239830758372694e-09 -1.634807350947523e-09 -8.349959592925347e-09 ] [ -1.49467322915751e-08 -1.346324715789124e-08 1.986425870721686e-08 ] [ 1.065118686189412e-09 -7.760365165395091e-09 -2.527370012900154e-09 ] [ -1.324792711703336e-08 1.916608781423057e-08 -2.826116912470878e-08 ] [ 3.636937148079175e-08 3.692331699785622e-09 1.927424002331742e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.457220224591099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.743430658396784e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1478782 1.3176322 0.7514803 ] [ 1.3416814 0.7435236 2.6972317 ] [ 2.3584362 0.3950504 0.5467834 ] [ 1.9201821 2.7113697 0.0753521 ] [ 3.1140029 2.1372287 2.0210832 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.478782e-11 1.3176322e-10 7.514803000000001e-11 ] [ 1.3416814e-10 7.435236e-11 2.6972317e-10 ] [ 2.3584362e-10 3.950504e-11 5.467834e-11 ] [ 1.9201821e-10 2.7113697e-10 7.535210000000001e-12 ] [ 3.1140029e-10 2.1372287e-10 2.0210832e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 3.8e-06 4.2e-06 ] [ 3.5e-06 -6.6e-06 -6.7e-06 ] [ -4.3e-06 7.9e-06 7.1e-06 ] [ 3.8e-06 -6.5e-06 -2.9e-06 ] [ -6e-06 1.5e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-15 6.08827115904e-15 6.72914180736e-15 ] [ 5.6076181728e-15 -1.057436569728e-14 -1.073458335936e-14 ] [ -6.889359469440001e-15 1.265719530432e-14 1.137545400768e-14 ] [ 6.08827115904e-15 -1.04141480352e-14 -4.646312200320001e-15 ] [ -9.6130597248e-15 2.4032649312e-15 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }