{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0847816 0.0351051 -0.1684015 ] [ 0.1685709 -0.9035385 1.0379926 ] [ -1.8682241 1.2652426 -0.8145558 ] [ 2.3959684 1.7848661 -3.0374537 ] [ -1.0623669 -1.2502399 3.0158248 ] [ 1.2439824 -1.19134 -0.5762804 ] [ -1.0712587 -0.4388488 -0.7672533 ] [ 3.2781095 0.6987534 1.3101273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.942364959794017e-09 5.624457049084608e-11 -2.698089462076513e-10 ] [ 2.700803549272147e-10 -1.447628260692701e-09 1.663047476283406e-09 ] [ -2.993224975435121e-09 2.027142113360206e-09 -1.305062259097041e-09 ] [ 3.838764554655582e-09 2.859670736678475e-09 -4.866537304902457e-09 ] [ -1.702099409891772e-09 -2.00310513817133e-09 4.831883986988835e-09 ] [ 1.993079517966674e-09 -1.908737095423872e-09 -9.233029839052724e-10 ] [ -1.716345643968601e-09 -7.03113287426135e-10 -1.229275299491649e-09 ] [ 5.252110401322377e-09 1.119526361184511e-09 2.099055330331828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.205137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.320049419186105e-18 } }