{ "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" [ [ 0.3741448 -0.4748152 -0.8242628 ] [ -0.2987799 0.2056763 -0.040445 ] [ 1.309809 1.8757619 -0.6726376 ] [ -2.096286 1.3199018 -1.6766745 ] [ -0.8137385 0.3033405 1.4738838 ] [ -1.0415141 -0.8644895 1.4933096 ] [ 0.7236763 -1.9545121 0.1170335 ] [ 1.8426884 -0.4108636 0.1297931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.994460562926031e-10 -7.607378189080367e-10 -1.320614598435415e-09 ] [ -4.786981744888565e-10 3.295297620275742e-10 -6.480003396213e-11 ] [ 2.098545374802906e-09 3.005301887127444e-09 -1.077684245869838e-09 ] [ -3.358620447381324e-09 2.114715823134541e-09 -2.686328706723633e-09 ] [ -1.303752810886209e-09 4.86005061245877e-10 2.361422185591129e-09 ] [ -1.668689555001539e-09 -1.385064877238343e-09 2.392545748447886e-09 ] [ 1.159457258439574e-09 -3.131473617490271e-09 1.87508339095239e-10 ] [ 2.952312298222845e-09 -6.582760596811223e-10 2.079514720744254e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.91274407419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.151679307848943e-18 } }