{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4041823 -0.5043984 -0.8494836 ] [ -0.2749921 0.1099429 -0.0357649 ] [ 1.1189456 1.7952721 -0.4738575 ] [ -1.9348252 1.1020093 -1.470926 ] [ -0.7201867 0.1770612 1.323558 ] [ -0.8825075 -0.7288684 1.2996721 ] [ 0.62463 -1.6334579 0.0061065 ] [ 1.6647537 -0.3175606 0.2006955 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.475714316011718e-10 -8.081353240489268e-10 -1.361022763673019e-09 ] [ -4.405859135246957e-10 1.761479440029523e-10 -5.730168662524992e-11 ] [ 1.792748480267028e-09 2.87634298659452e-09 -7.59203408090736e-10 ] [ -3.099931700774684e-09 1.765613536364173e-09 -2.356683248126861e-09 ] [ -1.153866293351103e-09 2.83683315090793e-10 2.120573683872806e-09 ] [ -1.413932884180656e-09 -1.167775910119903e-09 2.08230425332604e-09 ] [ 1.000767582650304e-09 -2.617088058441064e-09 9.7836915349152e-12 ] [ 2.667229457530297e-09 -5.087881690072205e-10 3.215496379997664e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.991266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.523389224699394e-18 } }