{ "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" [ [ 0.3576513 -0.5694623 -1.0155197 ] [ -0.2292942 0.1740799 -0.0144572 ] [ 1.3650999 2.1426964 -0.766553 ] [ -2.3102705 1.4864725 -1.9199233 ] [ -0.9990879 0.3595913 1.7344787 ] [ -1.0983791 -1.0232198 1.6884649 ] [ 0.6992271 -2.1538098 0.116916 ] [ 2.2150533 -0.4163481 0.1765936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.730205512587271e-10 -9.123791834869958e-10 -1.62704192130183e-09 ] [ -3.673698065250393e-10 2.789067459312019e-10 -2.316298784222976e-11 ] [ 2.187131144836418e-09 3.432978077552325e-09 -1.228153295204103e-09 ] [ -3.701461382823927e-09 2.381591486962128e-09 -3.076056224989184e-09 ] [ -1.600715275504168e-09 5.761287739030791e-10 2.778941222415577e-09 ] [ -1.759797314795345e-09 -1.639378841499652e-09 2.70521898782141e-09 ] [ 1.120285312249784e-09 -3.450783707209924e-09 1.873200817974528e-10 ] [ 3.548906611085889e-09 -6.670631919345005e-10 2.829341373029068e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.039177 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.774112682227309e-18 } }