{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] "source-value" [ 5.44976 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] "source-value" [ -0.0355309 5.38277 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] "source-value" [ 0.05055 0.148675 5.46244 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.749503490224367e-09 2.044591899590325e-09 -6.229094633342879e-09 ] [ -6.48625183164672e-12 -9.708677625529344e-11 5.1768853250579e-09 ] [ 1.590327883818536e-09 -2.329859446923765e-09 2.712806255426871e-09 ] [ -3.559884565073949e-09 -3.662760165677854e-09 4.354214413834427e-09 ] [ 3.596864884311619e-09 4.156931356938192e-09 -4.332318907916912e-09 ] [ 9.00477574677045e-10 -1.031601631935262e-09 -2.579311136987531e-09 ] [ 1.320461900123184e-09 2.694962654183359e-09 -1.29303744290495e-09 ] [ -5.591265076466819e-09 -1.775177889919701e-09 2.189856287050737e-09 ] ] "source-value" [ [ 1.0919542 1.2761339 -3.8878951 ] [ -0.0040484 -0.0605968 3.2311577 ] [ 0.9926046 -1.4541839 1.6932005 ] [ -2.2219052 -2.2861151 2.7176869 ] [ 2.2449865 2.5945525 -2.7040208 ] [ 0.5620339 -0.6438751 -1.6098794 ] [ 0.8241675 1.6820634 -0.8070505 ] [ -3.4897932 -1.1079789 1.3668008 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.676128526846705e-18 "source-value" -35.427608 } }