{ "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" [ [ 0.3698948 -0.6498117 -1.1163494 ] [ -0.2638393 0.1574736 -0.0074826 ] [ 1.6614772 2.5378842 -1.0473902 ] [ -2.7378771 1.9048142 -2.2338078 ] [ -1.0994483 0.4655013 1.9554848 ] [ -1.4627726 -1.3692549 1.9687594 ] [ 1.0593139 -2.5883961 0.3639251 ] [ 2.4732514 -0.4582105 0.1168608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.926368007154919e-10 -1.041113113662303e-09 -1.788588909324107e-09 ] [ -4.227171581082375e-10 2.523005203132109e-10 -1.198844678279808e-11 ] [ 2.661979925832246e-09 4.066138731537712e-09 -1.678104091295036e-09 ] [ -4.386562680243704e-09 3.051848778207855e-09 -3.578954632520683e-09 ] [ -1.761510362038305e-09 7.45815299812007e-10 3.133032028889764e-09 ] [ -2.34362006126683e-09 -2.193788188695842e-09 3.154300282660235e-09 ] [ 1.697207964668469e-09 -4.147067716789899e-09 5.830722869423022e-10 ] [ 3.962585570440869e-09 -7.341341505050785e-10 1.872316416479847e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.924321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.755710722431447e-18 } }