{ "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" [ [ 1.1778543 1.1160205 -4.289749 ] [ 0.1062877 -0.2539077 3.9247533 ] [ 1.1079358 -1.5938961 1.6294518 ] [ -2.4041969 -2.3442123 2.9749186 ] [ 2.3151541 2.8990103 -3.0600279 ] [ 0.607349 -0.77247 -1.6888565 ] [ 0.9195728 2.0229251 -1.0536451 ] [ -3.8299568 -1.0734698 1.5631548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.887130622168749e-09 1.788061953433527e-09 -6.872935556900178e-09 ] [ 1.702916680186042e-10 -4.068049807811002e-10 6.288147979667648e-09 ] [ 1.775108836107345e-09 -2.553703067404299e-09 2.610669578680477e-09 ] [ -3.851948064979836e-09 -3.755842141251797e-09 4.766345029703067e-09 ] [ 3.709285772569265e-09 4.644726526118395e-09 -4.902705160375721e-09 ] [ 9.730803684662592e-10 -1.237633374269376e-09 -2.705846400186115e-09 ] [ 1.473318041283594e-09 3.241083300849502e-09 -1.688125545840478e-09 ] [ -6.136267243633982e-09 -1.719888216694852e-09 2.5044500752513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.927586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.275580846858139e-18 } }