{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.55975e-10 0.0 0.0 ] "source-value" [ 5.55975 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] "source-value" [ 0.00335003 5.48819 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] "source-value" [ 0.0164792 -0.0422926 5.51812 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.256327090427884e-09 -1.358212706097798e-09 -2.306411912513682e-09 ] [ -9.796440054286906e-10 1.619613108964166e-10 -2.21725222552512e-11 ] [ 2.843160947471779e-09 4.444600086373225e-09 -1.042115114920952e-09 ] [ -5.012433751039775e-09 2.700303029295809e-09 -3.623172464207493e-09 ] [ -1.740393834393823e-09 3.384506787372614e-10 3.404046613004567e-09 ] [ -2.038555699171461e-09 -1.812794753928816e-09 3.183275967282728e-09 ] [ 1.484940550926202e-09 -3.879484354126201e-09 -9.96786173747616e-11 ] [ 4.186598540990221e-09 -5.948232911498976e-10 5.062282112025063e-10 ] ] "source-value" [ [ 0.7841377 -0.8477297 -1.4395491 ] [ -0.6114457 0.1010883 -0.013839 ] [ 1.7745615 2.7741012 -0.6504371 ] [ -3.1285151 1.6853966 -2.2614064 ] [ -1.0862684 0.2112443 2.1246388 ] [ -1.2723664 -1.1314575 1.9868446 ] [ 0.926827 -2.4213837 -0.0622145 ] [ 2.6130693 -0.3712595 0.3159628 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.364231842769596e-18 "source-value" -33.480902 } }