{ "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" [ [ 0.7892025 0.7926753 -3.9757413 ] [ 0.3080469 -0.3439797 4.1479737 ] [ 0.8528496 -1.6429978 1.6404843 ] [ -1.7489552 -1.7778508 2.5821113 ] [ 1.528971 2.6085485 -2.8286964 ] [ 0.6085636 -0.709803 -1.9825067 ] [ 0.8248248 1.8096722 -0.9835041 ] [ -3.1635033 -0.7362646 1.3998791 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.264441794576912e-09 1.270005833545626e-09 -6.369839761208999e-09 ] [ 4.935455412899156e-10 -5.511162333697978e-10 6.645786485833272e-09 ] [ 1.366415690178632e-09 -2.632372663185835e-09 2.628345592249454e-09 ] [ -2.802135132266588e-09 -2.848430987030577e-09 4.136998357163495e-09 ] [ 2.449681590081197e-09 4.179355420922909e-09 -4.532071239421126e-09 ] [ 9.75026372189883e-10 -1.137229771973702e-09 -3.17632588531936e-09 ] [ 1.321515010816036e-09 2.899414490151702e-09 -1.575747275480945e-09 ] [ -5.068491027083648e-09 -1.179625928842664e-09 2.242853565966545e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.493375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.68666556182872e-18 } }