{ "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" [ [ -2.8494451 0.217379 -0.1158053 ] [ 0.0954357 -0.5901936 0.7413328 ] [ -1.9477327 1.546963 -1.2388645 ] [ 2.3723371 1.8041079 -2.8734067 ] [ -1.3211926 -1.3287745 3.033381 ] [ 1.038241 -1.3936548 -0.2281954 ] [ -0.7212038 -0.3106746 -0.5960595 ] [ 3.3335606 0.0548477 1.2776177 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.565314359085793e-09 3.48279554522286e-10 -1.855405457533602e-10 ] [ 1.529048485894338e-10 -9.455943954563422e-10 1.187746090177795e-09 ] [ -3.120611821217731e-09 2.478507972262542e-09 -1.984879754592093e-09 ] [ 3.800903069591321e-09 2.890499522594808e-09 -4.603705074719047e-09 ] [ -2.116783912733708e-09 -2.128931455755033e-09 4.860012160219553e-09 ] [ 1.663445470660794e-09 -2.232881156421943e-09 -3.656093378662835e-10 ] [ -1.155495876712009e-09 -4.977555848972963e-10 -9.54992603373723e-10 ] [ 5.340952901343021e-09 8.78757033686418e-11 2.046969226124821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.701413 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.719996970938384e-18 } }