{ "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" [ [ 0.4903927 -0.6975772 -1.1667558 ] [ -0.2788283 0.2072894 -0.0799918 ] [ 1.6139662 2.6411734 -0.7570834 ] [ -2.7548005 1.6325091 -2.175597 ] [ -1.0754428 0.3041975 1.8970988 ] [ -1.3642024 -1.0681116 1.9318978 ] [ 0.9460478 -2.4745366 0.0598559 ] [ 2.4228675 -0.544944 0.2905754 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.856957189509881e-10 -1.117641881043126e-09 -1.869348864942801e-09 ] [ -4.467321834774086e-10 3.321142304196596e-10 -1.281609918157094e-10 ] [ 2.585858912401417e-09 4.231626272958846e-09 -1.212981323475775e-09 ] [ -4.413676956068151e-09 2.615567913263249e-09 -3.485690649682617e-09 ] [ -1.72304931116769e-09 4.87378122605808e-10 3.039487344707735e-09 ] [ -2.18569319131925e-09 -1.711303433925281e-09 3.095241488934954e-09 ] [ 1.515735667319274e-09 -3.964644687833921e-09 9.589972359694272e-11 ] [ 3.881861663796144e-09 -8.730965364452353e-10 4.655531124596083e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.573536 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.379073445678714e-18 } }