{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6838897 -3.6752028 -0.1579575 ] [ 0.3269946 1.7579421 0.9984547 ] [ 1.6769808 -1.4859039 2.0072215 ] [ -3.1606685 3.6943718 -4.4389414 ] [ -0.2913417 -1.0203888 1.3833775 ] [ -1.1491363 3.5069514 -2.3202471 ] [ 4.1323457 -4.4959068 4.2192115 ] [ -2.2190643 1.7181369 -1.6911192 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.095712088545926e-09 -5.888324002858699e-09 -2.53075813580016e-10 ] [ 5.239031032478477e-10 2.816533733340056e-09 1.599700777267878e-09 ] [ 2.686819431290481e-09 -2.380680489335541e-09 3.215923360067107e-09 ] [ -5.063949176799005e-09 5.919036126502814e-09 -7.111968132181222e-09 ] [ -4.667808604041274e-10 -1.634843079486167e-09 2.216415088240752e-09 ] [ -1.841119313972615e-09 5.618755543361829e-09 -3.717445658099e-09 ] [ 6.620747669603411e-09 -7.203236764255742e-09 6.7599220235105e-09 ] [ -3.555332941511917e-09 2.752758772513787e-09 -2.709471645225999e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.856562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.744854533866569e-18 } }