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greater than 1%.\nSee pipeline.stdout for calculation details." 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details." "prototype-label" { "source-value" "A2B_aP12_1_8a_4a" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 5.3799 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.3799e-10 } "parameter-names" { "source-value" [ "b/a" "c/a" "alpha" "beta" "gamma" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" "x10" "y10" "z10" "x11" "y11" "z11" "x12" "y12" "z12" ] } "parameter-values" { "source-value" [ 0.79613004 1.3200245 96.5549 89.6583 104.5129 0.20137892 0.97746648 0.38438318 0.37930434 0.79266623 0.39590362 0.96486862 0.45229804 0.55509103 0.50514123 0.43304058 0.75505314 0.72621539 0.96303077 0.77620487 0.69956886 0.72086129 0.055808384 0.020294381 0.38596065 0.16184749 0.22435143 0.8309346 0.92634933 0.96930384 0.61727469 0.0085351368 0.4983505 0.75903475 0.89482215 0.15045459 0.45953229 0.37717739 0.76602794 0.30767961 0.70882426 ] } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "coordinates-file" { "source-value" "instance-4.poscar" } "crystal-genome-source-structure-id" { "source-value" [ "TE_813636514567_002-and-SM_714124634215_000-1711747665-tr:4" ] } "isothermal-bulk-modulus" { "source-value" 118.12114579207581 "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" 118121145792.0758 } } ]