{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6963475 -0.8795321 -5.0113858 ] [ -7.8818132 -0.3315289 9.2285028 ] [ -0.6644305 -10.9379002 -0.888327 ] [ 7.645001 1.0788535 5.8216828 ] [ -0.851387 4.1361258 -1.2652438 ] [ 11.4479634 0.1183803 -11.8517537 ] [ -0.998986 6.8156016 3.9665247 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393308465085253e-08 -1.409165767863128e-09 -8.029125166569106e-09 ] [ -1.262805683855283e-08 -5.311678526995411e-10 1.478569143114734e-08 ] [ -1.064535013246454e-09 -1.752444798108365e-08 -1.423256751025402e-09 ] [ 1.224864186819262e-08 1.728513854968253e-09 9.327364075873482e-09 ] [ -1.36407234665305e-09 6.626804057447698e-09 -2.027144035972151e-09 ] [ 1.834165931525408e-08 1.896661490232902e-10 -1.89886026936199e-08 ] [ -1.600552013706509e-09 1.091979754020707e-08 6.355073140165734e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1659239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.868016014211957e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6602486 2.5992617 1.6541146 ] [ 1.6908398 3.2349514 3.9863631 ] [ 3.4741789 1.028825 1.3577955 ] [ 5.5236956 3.4823882 3.5340554 ] [ 3.22974 4.4554605 1.1610451 ] [ 5.0931569 2.8208872 1.249002 ] [ 3.4959072 4.796807 3.6032834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6602486e-10 2.5992617e-10 1.6541146e-10 ] [ 1.6908398e-10 3.2349514e-10 3.9863631e-10 ] [ 3.4741789e-10 1.028825e-10 1.3577955e-10 ] [ 5.5236956e-10 3.4823882e-10 3.5340554e-10 ] [ 3.22974e-10 4.4554605e-10 1.1610451e-10 ] [ 5.093156900000001e-10 2.8208872e-10 1.249002e-10 ] [ 3.4959072e-10 4.796807000000001e-10 3.6032834e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 6e-07 4e-06 ] [ -7.4e-06 -2.5e-06 -2.7e-06 ] [ -5.9e-06 4.5e-06 -3.5e-06 ] [ 7.3e-06 6.6e-06 -2e-06 ] [ -2e-07 -5e-06 -4e-07 ] [ 3.8e-06 -1.2e-06 4.5e-06 ] [ 2.1e-06 -3.1e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 9.6130597248e-16 6.4087064832e-15 ] [ -1.185610699392e-14 -4.005441552e-15 -4.32587687616e-15 ] [ -9.45284206272e-15 7.2097947936e-15 -5.6076181728e-15 ] [ 1.169588933184e-14 1.057436569728e-14 -3.2043532416e-15 ] [ -3.2043532416e-16 -8.010883104e-15 -6.408706483200001e-16 ] [ 6.08827115904e-15 -1.92261194496e-15 7.2097947936e-15 ] [ 3.36457090368e-15 -4.96674752448e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }