{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2147651 -3.9965753 -2.081269 ] [ -4.5349225 -1.4519646 1.4138465 ] [ -1.3603987 2.7962621 -1.2434964 ] [ 0.7486991 -0.3186958 3.2946316 ] [ 3.931857 2.9709736 -1.3837127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.946268242983774e-09 -6.403219508926747e-09 -3.334560533395795e-09 ] [ -7.265746806639889e-09 -2.326303736349223e-09 2.265231807699907e-09 ] [ -2.179598992106713e-09 4.480105762249111e-09 -1.992300860128965e-09 ] [ 1.199548194034001e-09 -5.106069599071526e-10 5.278581723668898e-09 ] [ 6.299529361728825e-09 4.760024442934011e-09 -2.216952137844045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0595664 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.451502548066522e-18 } "relaxed-configuration-positions" { "source-value" [ [ 4.201236 1.1340251 2.6176156 ] [ 0.8163566 2.4887172 3.6998966 ] [ 1.6695676 3.9250216 2.0249123 ] [ 2.552558 1.001377 4.3103649 ] [ 3.8363617 3.1638072 1.4573966 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.201236e-10 1.1340251e-10 2.6176156e-10 ] [ 8.163566e-11 2.4887172e-10 3.6998966e-10 ] [ 1.6695676e-10 3.9250216e-10 2.0249123e-10 ] [ 2.552558e-10 1.001377e-10 4.3103649e-10 ] [ 3.8363617e-10 3.1638072e-10 1.4573966e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -4.5e-06 -6e-07 ] [ 5.8e-06 -5.9e-06 -3.6e-06 ] [ -2.5e-06 3.5e-06 -1.9e-06 ] [ 1.4e-06 2.2e-06 5.7e-06 ] [ 2.5e-06 4.7e-06 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 -7.2097947936e-15 -9.6130597248e-16 ] [ 9.292624400640001e-15 -9.45284206272e-15 -5.76783583488e-15 ] [ -4.005441552e-15 5.6076181728e-15 -3.04413557952e-15 ] [ 2.24304726912e-15 3.52478856576e-15 9.13240673856e-15 ] [ 4.005441552e-15 7.53023011776e-15 4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }