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20162024
most citedExoMol molecular line lists XIX: high accuracy computed hot line lists for HO and HO

77 citations · 257 across the 10 of their papers we have counts for

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Showing 2018Show all

5 papers · 1 filter

physics.chem-ph2018★ 22 cited

A global potential energy surface for H

I. I. Mizus, O. L. Polyansky, Laura K. McKemmish +3

A globally correct potential energy surface (PES) for the \hp\ molecular ion is presented. The Born-Oppenheimer (BO) \ai\ grid points of Pavanello et. al. [\textit{J. Chem. Phys.}…

physics.chem-ph2018

A new spectroscopically-determined potential energy surface and \emph{ab initio} dipole moment surface for high accuracy HCN intensity calculations

Vladimir Yu. Makhnev, Aleksandra A. Kyuberis, Oleg L. Polyansky +3

Calculations of transition intensities for small molecules like HO, CO, CO based on s high-quality potential energy surface (PES) and dipole moment surface (DMS) can nowada…

astro-ph.EP2018

ExoMol molecular line lists XXX: a complete high-accuracy line list for water

Oleg L. Polyansky, Aleksandra A. Kyuberis, Nikolai F. Zobov +3

A new line list for HO is presented. This line list, which is called POKAZATEL, includes transitions between rotation-vibrational energy levels up to 41000 cm in…

physics.chem-ph2018

High accuracy water potential energy surface for the calculation of infrared spectra

Irina I. Mizus, Aleksandra A. Kyuberis, Nikolai F. Zobov +3

Transition intensities for small molecules such as water and CO can now be computed with such high accuracy that they are being used to systematically replace measurements in s…

physics.ao-ph2018

Potential energy surface, dipole moment surface and the intensity calculations for the 10 micron, 5 micron, and 3 micron bands of ozone

Oleg L. Polyansky, Nikolai F. Zobov, Irina I. Mizus +3

Monitoring ozone concentrations in the Earth's atmosphere using spectroscopic methods is a major activity which undertaken both from the ground and from space. However there are lo…