Abstract

The cubic and quartic force fields of AsH3, SbH3, and BiH3 are determined from ab initio calculations using effective core potentials and polarized double-zeta valence basis sets. The computed geometries, dipole moments, rotational constants, vibration-rotation interaction constants, l-doubling constants, anharmonicity constants, vibrational wavenumbers, centrifugal distortion constants, and Coriolis coupling constants are compared with the available experimental data for AsH3 and SbH3. The vibrational wavenumbers and other spectroscopic constants for the BiH3 molecule are predicted.

Full Text
Paper version not known

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call

Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.