{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2103141 1.1173386 -2.5825997 ] [ -0.7003512 0.4624905 0.3555186 ] [ -0.6938927 -0.8501142 -1.5272122 ] [ -1.083776 -0.6830712 3.4606868 ] [ 3.4427575 1.4568003 -1.6669654 ] [ -0.1542699 -1.990283 -0.3912763 ] [ -0.3997577 1.0641534 0.2126992 ] [ -1.6210242 -0.5773142 2.139149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.939136970820739e-09 1.790173797186272e-09 -4.137780894315409e-09 ] [ -1.122086328233861e-09 7.40991472546977e-10 5.696035938723923e-10 ] [ -1.111738670443172e-09 -1.362033107471603e-09 -2.446863701999734e-09 ] [ -1.736400583689984e-09 -1.094400715998341e-09 5.54463152855223e-09 ] [ 5.515905623028254e-09 2.33405140106419e-09 -2.670773013566463e-09 ] [ -2.471676291095165e-10 -3.188784917647422e-09 -6.268937452979742e-10 ] [ -6.404824462015817e-10 1.704961712471655e-09 3.407816883104928e-10 ] [ -2.597167096388543e-09 -9.249593217164027e-10 3.427294544444466e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.860613 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.745503622951664e-18 } }