{ "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" [ [ 2.920062 0.4752338 -3.8740495 ] [ -0.2793481 -1.3452156 4.0562753 ] [ -0.1993416 -3.0333063 -1.4026964 ] [ 0.66929 1.3466027 5.9216909 ] [ -0.4314038 2.1511622 -2.4127427 ] [ -1.0974693 1.2822138 0.9154761 ] [ 1.2780875 0.0671511 -4.0249304 ] [ -2.8598767 -0.9438418 0.8209767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.678455106231308e-09 7.61408490047029e-10 -6.206911587859382e-09 ] [ -4.475649985722954e-10 -2.15527300201229e-09 6.498869506731339e-09 ] [ -3.193804537041744e-10 -4.859892477624993e-09 -2.247367396675917e-09 ] [ 1.07232079936986e-09 2.157495381221312e-09 9.487594793750429e-09 ] [ -6.911850881788092e-10 3.446541812784034e-09 -3.865639977794071e-09 ] [ -1.758339668992336e-09 2.054332990152349e-09 1.466754416405447e-09 ] [ 2.047721928707475e-09 1.075879233673974e-10 -6.448649440356273e-09 ] [ -4.582027624861027e-09 -1.512201278152501e-09 1.315349685798428e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.477697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.684153716153189e-18 } }