List of works - Andrey Yachmenev

A Hyperfine-resolved Rotation–Vibration Line List of Ammonia (NH3)

scientific article published on 31 December 2018

A global ab initio dipole moment surface for methyl chloride

A global potential energy surface and dipole moment surface for silane

scientific article published on December 2015

A highly accurate ab initio potential energy surface for methane ⬇️

scientific article published in September 2016

A new “spectroscopic” potential energy surface for formaldehyde in its ground electronic state ⬇️

scientific article published on June 28, 2011

A semi-classical approach to the calculation of highly excited rotational energies for asymmetric-top molecules.

scientific article

A theoretical-spectroscopy, ab initio-based study of the electronic ground state of 121SbH3

article published in 2010

A variationally computed T = 300 K line list for NH3.

scientific article published in October 2009

Accurate ab initio vibrational energies of methyl chloride

article

An ab initio calculation of the vibrational energies and transition moments of HSOH

article

Automatic differentiation method for numerical construction of the rotational-vibrational Hamiltonian as a power series in the curvilinear internal coordinates using the Eckart frame

scientific article published in July 2015

Climbing the Rotational Ladder to Chirality

scientific article published on 01 November 2018

Coherent Control of the Rotation Axis of Molecular Superrotors

Communication: General variational approach to nuclear-quadrupole coupling in rovibrational spectra of polyatomic molecules

scientific article published in October 2017

Detecting Chirality in Molecules by Linearly Polarized Laser Fields

scientific article

Detection of electric-quadrupole transitions in water vapour near 5.4 and 2.5 μm

scientific article published on 29 May 2020

ExoMol line lists – VIII. A variationally computed line list for hot formaldehyde ⬇️

scholarly article

ExoMol line lists – XXII. The rotation-vibration spectrum of silane up to 1200 K

article

High-level ab initio potential energy surfaces and vibrational energies of H2CS

article

Laser-induced dynamics of molecules with strong nuclear quadrupole coupling

scientific article published on 01 December 2019

On the use of quartic force fields in variational calculations

scientific article published in June 2013

RichMol: A general variational approach for rovibrational molecular dynamics in external electric fields

scientific article published in March 2018

Ro-vibrational averaging of the isotropic hyperfine coupling constant for the methyl radical.

scientific article published on December 2015

Simulating electric field interactions with polar molecules using spectroscopic databases.

scientific article

Symmetry-Adapted Ro-vibrational Basis Functions for Variational Nuclear Motion Calculations: TROVE Approach

scientific article published in August 2017

The Effect of Nuclear-Quadrupole Coupling in the Laser-Induced Alignment of Molecules

scientific article published on 09 March 2020

The ExoMol database: Molecular line lists for exoplanet and other hot atmospheres ⬇️

scientific article published in September 2016

The rotation–vibration spectrum of methyl fluoride from first principles

article

Theoretical rotation-vibration spectrum of thioformaldehyde

scientific article

Theoretical rotation–torsion spectra of HSOH

article

List of works by Andrey Yachmenev

A Hyperfine-resolved Rotation–Vibration Line List of Ammonia (NH3)

A global ab initio dipole moment surface for methyl chloride

A global potential energy surface and dipole moment surface for silane

A highly accurate ab initio potential energy surface for methane ⬇️

A new “spectroscopic” potential energy surface for formaldehyde in its ground electronic state ⬇️

A semi-classical approach to the calculation of highly excited rotational energies for asymmetric-top molecules.

A theoretical-spectroscopy, ab initio-based study of the electronic ground state of 121SbH3

A variationally computed T = 300 K line list for NH3.

Accurate ab initio vibrational energies of methyl chloride

An ab initio calculation of the vibrational energies and transition moments of HSOH

Automatic differentiation method for numerical construction of the rotational-vibrational Hamiltonian as a power series in the curvilinear internal coordinates using the Eckart frame

Climbing the Rotational Ladder to Chirality

Coherent Control of the Rotation Axis of Molecular Superrotors

Communication: General variational approach to nuclear-quadrupole coupling in rovibrational spectra of polyatomic molecules

Detecting Chirality in Molecules by Linearly Polarized Laser Fields

Detection of electric-quadrupole transitions in water vapour near 5.4 and 2.5 μm

ExoMol line lists – VIII. A variationally computed line list for hot formaldehyde ⬇️

ExoMol line lists – XXII. The rotation-vibration spectrum of silane up to 1200 K

High-level ab initio potential energy surfaces and vibrational energies of H2CS

Laser-induced dynamics of molecules with strong nuclear quadrupole coupling

On the use of quartic force fields in variational calculations

RichMol: A general variational approach for rovibrational molecular dynamics in external electric fields

Ro-vibrational averaging of the isotropic hyperfine coupling constant for the methyl radical.

Simulating electric field interactions with polar molecules using spectroscopic databases.

Symmetry-Adapted Ro-vibrational Basis Functions for Variational Nuclear Motion Calculations: TROVE Approach

The Effect of Nuclear-Quadrupole Coupling in the Laser-Induced Alignment of Molecules

The ExoMol database: Molecular line lists for exoplanet and other hot atmospheres ⬇️

The rotation–vibration spectrum of methyl fluoride from first principles

Theoretical rotation-vibration spectrum of thioformaldehyde

Theoretical rotation–torsion spectra of HSOH

Thermal averaging of the indirect nuclear spin-spin coupling constants of ammonia: The importance of the large amplitude inversion mode