Lista de obras -

A molecular quantum switch based on tunneling in meta-d-phenol C6H4DOH

artículo científico publicado en 2018

Adiabatic Jacobi corrections on the vibrational energy levels of H2(+) isotopologues

artículo científico publicado en 2009

Assigning quantum labels to variationally computed rotational-vibrational eigenstates of polyatomic molecules

artículo científico publicado en 2010

Communication: rigidity of the molecular ion H(+)(5)

scientific article published on 01 February 2014

Controlling tunneling in ammonia isotopomers

scientific article published on 01 January 2019

Gas-phase and Ar-matrix SQM scaling factors for various DFT functionals with basis sets including polarization and diffuse functions

artículo científico publicado en 2011

High resolution GHz and THz (FTIR) spectroscopy and theory of parity violation and tunneling for 1,2-dithiine (C4H4S2) as a candidate for measuring the parity violating energy difference between enantiomers of chiral molecules.

artículo científico publicado en 2016

High-resolution FTIR spectroscopy of trisulfane HSSSH: a candidate for detecting parity violation in chiral molecules.

artículo científico publicado en 2017

Isotope effects on the resonance interactions and vibrational quantum dynamics of fluoroform 12,13CHF3.

artículo científico publicado en 2017

MARVEL analysis of the rotational–vibrational states of the molecular ions H2D+ and D2H+ ⬇️

artículo científico publicado el 14 de mayo de 2013

Numerically constructed internal-coordinate Hamiltonian with Eckart embedding and its application for the inversion tunneling of ammonia.

artículo científico publicado en 2013

On the use of nonrigid-molecular symmetry in nuclear motion computations employing a discrete variable representation: A case study of the bending energy levels of CH5.

artículo científico publicado en 2017

Quantum light-induced nonadiabatic phenomena in the absorption spectrum of formaldehyde: Full- and reduced-dimensionality studies

artículo científico publicado en 2020

Reduced-Dimensional Quantum Computations for the Rotational–Vibrational Dynamics of F––CH4 and F––CH2D2 ⬇️

artículo científico publicado el 5 de marzo de 2013

Rotating full- and reduced-dimensional quantum chemical models of molecules.

artículo científico publicado en 2011

Rovibrational quantum dynamics of the vinyl radical and its deuterated isotopologues

artículo científico publicado en 2019

Temperature-dependent, effective structures of the 14NH3 and 14ND3 molecules.

artículo científico publicado en 2012

The fourth age of quantum chemistry: molecules in motion.

artículo científico publicado en 2011

The role of axis embedding on rigid rotor decomposition analysis of variational rovibrational wave functions

artículo científico publicado en 2012

Tunneling and Parity Violation in Trisulfane (HSSSH): An Almost Ideal Molecule for Detecting Parity Violation in Chiral Molecules

scientific article published on 16 November 2015

Vibrational quantum graphs and their application to the quantum dynamics of CH5

artículo científico publicado en 2018

Lista de obras de

A molecular quantum switch based on tunneling in meta-d-phenol C6H4DOH

Adiabatic Jacobi corrections on the vibrational energy levels of H2(+) isotopologues

Assigning quantum labels to variationally computed rotational-vibrational eigenstates of polyatomic molecules

Communication: rigidity of the molecular ion H(+)(5)

Controlling tunneling in ammonia isotopomers

Gas-phase and Ar-matrix SQM scaling factors for various DFT functionals with basis sets including polarization and diffuse functions

High resolution GHz and THz (FTIR) spectroscopy and theory of parity violation and tunneling for 1,2-dithiine (C4H4S2) as a candidate for measuring the parity violating energy difference between enantiomers of chiral molecules.

High-resolution FTIR spectroscopy of trisulfane HSSSH: a candidate for detecting parity violation in chiral molecules.

Isotope effects on the resonance interactions and vibrational quantum dynamics of fluoroform 12,13CHF3.

MARVEL analysis of the rotational–vibrational states of the molecular ions H2D+ and D2H+ ⬇️

Numerically constructed internal-coordinate Hamiltonian with Eckart embedding and its application for the inversion tunneling of ammonia.

On the use of nonrigid-molecular symmetry in nuclear motion computations employing a discrete variable representation: A case study of the bending energy levels of CH5.

Quantum light-induced nonadiabatic phenomena in the absorption spectrum of formaldehyde: Full- and reduced-dimensionality studies

Reduced-Dimensional Quantum Computations for the Rotational–Vibrational Dynamics of F––CH4 and F––CH2D2 ⬇️

Rotating full- and reduced-dimensional quantum chemical models of molecules.

Rovibrational quantum dynamics of the vinyl radical and its deuterated isotopologues

Temperature-dependent, effective structures of the 14NH3 and 14ND3 molecules.

The fourth age of quantum chemistry: molecules in motion.

The role of axis embedding on rigid rotor decomposition analysis of variational rovibrational wave functions

Tunneling and Parity Violation in Trisulfane (HSSSH): An Almost Ideal Molecule for Detecting Parity Violation in Chiral Molecules

Vibrational quantum graphs and their application to the quantum dynamics of CH5