{ "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" [ [ 0.6706616 -1.0421132 -1.6448157 ] [ -0.1217485 0.2543795 -0.132088 ] [ 1.6413852 3.5350756 -0.2313787 ] [ -3.2589101 1.3579806 -2.3967811 ] [ -1.2208562 -0.0750057 2.0434726 ] [ -1.3417006 -0.7565342 2.0418661 ] [ 0.9744456 -2.4421267 -0.3657781 ] [ 2.656723 -0.831656 0.6855029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.074518335988321e-09 -1.669649405267075e-09 -2.635285260064787e-09 ] [ -1.950626003174688e-10 4.075608877107935e-10 -2.116283054882304e-10 ] [ 2.629788993167132e-09 5.663815479080532e-09 -3.707095436910969e-10 ] [ -5.22134957150899e-09 2.175724768819957e-09 -3.840066643595307e-09 ] [ -1.956027260998729e-09 -1.201723789667386e-10 3.27400402496539e-09 ] [ -2.149641333433333e-09 -1.212101408075631e-09 3.271430128224075e-09 ] [ 1.561233958561429e-09 -3.912718303771456e-09 -5.860411202206445e-10 ] [ 4.256539478541638e-09 -1.332459799748045e-09 1.0982967198706e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.889362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750109673182793e-18 } }