{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5388447 0.0554855 -2.0293136 ] [ 0.2300023 -0.6748877 1.9088898 ] [ 0.0885452 -1.2006434 -0.2377491 ] [ 0.205452 0.709639 3.1351672 ] [ -0.6483486 1.1992067 -1.0391313 ] [ -0.7062604 0.7538589 0.5449816 ] [ 0.4660033 -0.5056149 -2.3284396 ] [ -1.1742385 -0.3370441 0.045595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.465501021694739e-09 8.889757162580699e-11 -3.251318832978422e-09 ] [ 3.685043108262581e-10 -1.081289303514002e-09 3.058378634440933e-09 ] [ 1.418650504928568e-10 -1.923642801246315e-09 -3.809160527745293e-10 ] [ 3.29170393808568e-10 1.136967024375126e-09 5.023091631523205e-09 ] [ -1.038768977606612e-09 1.921340954076247e-09 -1.664871888518044e-09 ] [ -1.131553910399493e-09 1.207815114912942e-09 8.731567854799343e-10 ] [ 7.466195986268922e-10 -8.100843785822466e-10 -3.730571520800306e-09 ] [ -1.881337487443209e-09 -5.400041816475594e-10 7.305124362722999e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -34.80615829230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.576561353523397e-18 } }