{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4921866 0.9440929 -2.0035784 ] [ -0.1432292 -0.5783605 2.260492 ] [ 0.0933777 -1.5123497 -0.4092622 ] [ 0.9219603 0.6046688 3.3668126 ] [ -0.4587843 1.1460903 -1.0628772 ] [ -0.56794 0.4938675 0.3529057 ] [ 0.5370645 -0.5897983 -2.5155991 ] [ -1.8746355 -0.5082111 0.0111066 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.390746484391041e-09 1.512603572243272e-09 -3.21008647041987e-09 ] [ -2.294784756558874e-10 -9.266356714941984e-10 3.621707433905434e-09 ] [ 1.496075678440762e-10 -2.423051331813894e-09 -6.557103286171739e-10 ] [ 1.477143237965754e-09 9.68786214687191e-10 5.394228434334862e-09 ] [ -7.350534794500934e-10 1.836239083985658e-09 -1.702917000621366e-09 ] [ -9.09940190017152e-10 7.91262962272944e-10 5.654172618870585e-10 ] [ 8.604721857616415e-10 -9.449610472475848e-10 -4.030434065325522e-09 ] [ -3.003497170621718e-09 -8.142439428510509e-10 1.779473485657728e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -36.86378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.906228647031462e-18 } }