{ "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" [ [ 0.3296007 -0.5357496 -0.9245539 ] [ -0.1985078 0.1707636 -0.0465987 ] [ 1.3329065 2.0587713 -0.8274585 ] [ -2.2222257 1.483513 -1.8399096 ] [ -0.9588504 0.4039852 1.6440535 ] [ -1.1599667 -1.0198719 1.6740705 ] [ 0.7654782 -2.1602435 0.2118568 ] [ 2.1115651 -0.4011682 0.10854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.280785400900438e-10 -8.583654907948464e-10 -1.481298655453572e-09 ] [ -3.180445588267452e-10 2.735934498577224e-10 -7.465934831477579e-11 ] [ 2.135551649606721e-09 3.298515271609804e-09 -1.325734674304689e-09 ] [ -3.560398092014294e-09 2.376849864835242e-09 -2.947860169792286e-09 ] [ -1.536247706381553e-09 6.472556479218167e-10 2.634064102745919e-09 ] [ -1.858471542958088e-09 -1.634014927853185e-09 2.682156638768697e-09 ] [ 1.226431285876379e-09 -3.461091659450379e-09 3.394320147140112e-10 ] [ 3.383100264389873e-09 -6.427423163438386e-10 1.7390025185436e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.087521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.781858292518431e-18 } }