tetraoxa[8]circulene sheet, Aromaticity, anisotropy of induced current density, Vibrational spectra, charge density difference, transition density matrix
Molecular data, stars, brown dwarfs, stellar atmosphere, opacity
4H-1, 2, 4-triazole and 1, 3, 5-triazine derivative, charge-transfer fluorescence, exciplex, OLED
MRCI+Q method, Spin-Orbit Coupling, Transition properties, NO, PO and PS molecules
Radiative association, S2, S2+, S2- molecular species, cross-section, rate coefficient
EOM-CCSD, Potential energy curves, Spectroscopic constants