Simulating chemistry on bosonic quantum devices

R Dutta, DGA Cabral, N Lyu, NP Vu… - Journal of Chemical …, 2024 - ACS Publications
Bosonic quantum devices offer a novel approach to realize quantum computations, where
the quantum two-level system (qubit) is replaced with the quantum (an) harmonic oscillator …

[图书][B] Semiclassical mechanics with molecular applications

MS Child - 2014 - books.google.com
The second edition of an established graduate text, this book complements the material for a
typical advanced graduate course in quantum mechanics by showing how the underlying …

Algebraic approach to two-dimensional systems: Shape phase transitions, monodromy, and thermodynamic quantities

F Pérez-Bernal, F Iachello - Physical Review A—Atomic, Molecular, and Optical …, 2008 - APS
We analyze shape phase transitions in two-dimensional algebraic models. We apply our
analysis to linear-to-bent transitions in molecules and point out what observables are …

Signatures of quantum phase transitions and excited state quantum phase transitions in the vibrational bending dynamics of triatomic molecules

D Larese, F Pérez-Bernal, F Iachello - Journal of Molecular Structure, 2013 - Elsevier
Signatures of quantum phase transitions (QPTs) and excited state quantum phase
transitions (ESQPTs) in the bending motion of eight XYZ triatomic molecules (HCN, HNC …

Normalization and global analysis of perturbations of the hydrogen atom

K Efstathiou, DA Sadovskii - Reviews of Modern Physics, 2010 - APS
The hydrogen atom perturbed by sufficiently small homogeneous static electric and
magnetic fields of arbitrary mutual alignment is a specific perturbation of the Kepler system …

Fulminic acid: a quasibent spectacle

AM Allen, LN Olive, PAG Franco, SR Barua… - Physical Chemistry …, 2024 - pubs.rsc.org
Fulminic acid (HCNO) played a critical role in the early development of organic chemistry,
and chemists have sought to discern the structure and characteristics of this molecule and its …

A study of quantum phase transitions and quantum monodromy in the bending motion of non-rigid molecules

D Larese, F Iachello - Journal of Molecular Structure, 2011 - Elsevier
The concepts of quantum phase transition (QPT) and excited state quantum phase transition
(ESQPT) are applied to the study of bending motion in non-rigid molecules. Two key …

[HTML][HTML] Excited state quantum phase transitions in the bending spectra of molecules

J Khalouf-Rivera, F Pérez-Bernal, M Carvajal - Journal of Quantitative …, 2021 - Elsevier
We present an extension of the Hamiltonian of the two dimensional limit of the vibron model
to encompass all possible interactions up to four-body operators. We apply this Hamiltonian …

Laboratory detection of HOCN and tentative identification in Sgr B2

S Brünken, CA Gottlieb, MC McCarthy… - The Astrophysical …, 2009 - iopscience.iop.org
The rotational spectrum of cyanic acid, HOCN, has been detected in the centimeter-wave
band in a molecular beam by Fourier transform microwave spectroscopy and in the …

Molecular spectroscopy and dynamics: a polyad-based perspective

M Herman, DS Perry - Physical Chemistry Chemical Physics, 2013 - pubs.rsc.org
The efficiency and insight of global, polyad-based modeling in overtone spectroscopy and
dynamics is demonstrated. Both vibration and vibration–rotation polyads are considered …