Tests: I. C6H5Br: Bromobenzene molecule r_ab expt* uspp ---- ---- ---- C-Br 1.87 1.90 C-H 1.07 1.09 C-C 1.40 1.39 * Microwave results interpreted by assuming that hexagonal symmetry of benzene ring is maintained. II. EA of Bromine (Br+e- -> Br-) Expt. 3.364 eV USPP. 3.409 eV * * Energy of Br- determined by Makov-Payne-type fitting & extrapolation, low symmetry (non-spherical) Br energy used in comparison. III. Br2 Dimer (isolated) Bond length: USPP- 2.30 Angstroms Expt- 2.28 Angstroms IV. fcc NaBr * Lattice Constant --------------- Expt 11.26 Bohr / USPP 11.417 Bohr Bulk Modulus ------------ Expt 19.47 GPa / USPP 17.62 GPa * Na potential: Na.pbe-sp-van_ak.UPF V. fcc AgBr * Lattice Constant --------------- Expt 10.91 Bohr / 11.05 Bohr Bulk Modulus ------------ Expt 44.03 GPa / USPP 40.18 GPa * Ag potential: Ag.pbe-d-rrkjus.UPF