{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44976 0 0 ] "si-unit" "m" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0355309 5.38277 0 ] "si-unit" "m" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.05055 0.148675 5.46244 ] "si-unit" "m" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1230183 1.2768952 -4.1272226 ] [ 0.0664202 -0.0881477 3.4623707 ] [ 1.0753288 -1.5266329 1.7303699 ] [ -2.3786142 -2.4455464 2.9517232 ] [ 2.3671915 2.791021 -2.9721755 ] [ 0.6143394 -0.7051642 -1.6210264 ] [ 0.8361602 1.8145412 -0.8613069 ] [ -3.7038443 -1.116966 1.4372676 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.799273664990561e-09 2.04581163665174e-09 -6.612539558557389e-09 ] [ 1.064168915888602e-10 -1.412281841172922e-10 5.54732938808293e-09 ] [ 1.722866663032919e-09 -2.445935540924105e-09 2.772358199116034e-09 ] [ -3.810960061142895e-09 -3.918197267161605e-09 4.729181902112963e-09 ] [ 3.792658878256483e-09 4.471708594361838e-09 -4.761950099014551e-09 ] [ 9.842802239162994e-10 -1.129797595065135e-09 -2.597170599779589e-09 ] [ 1.339676323683452e-09 2.907215488118377e-09 -1.379965778513723e-09 ] [ -5.934212744543341e-09 -1.789576811428493e-09 2.302756546553326e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.366788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.666384088638999e-18 } }