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20012024
most citedThe Variational Quantum Eigensolver: a review of methods and best practices

1.1k citations · 17k across the 213 of their papers we have counts for

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Showing 2019Show all

15 papers · 1 filter

astro-ph.SR2019★ 18 cited

Analysis of first overtone bands of isotopologues of CO and SiO in stellar spectra

Ya. V. Pavlenko, Sergei N. Yurchenko, Jonathan Tennyson

The first overtone ( = 2) bands of the monosubstituted isotopologues of CO at 2.3 m in the spectrum of Arcturus (K2 III), and of the monosubstituted isotopologues of SiO at…

astro-ph.SR2019★ 242 cited

ExoMol molecular line lists XXXV: a rotation-vibration line list for hot ammonia

Phillip A. Coles, Sergei N. Yurchenko, Jonathan Tennyson

A new hot line list for NH is presented. The line list CoYuTe was constructed using an accurate, empirically refined potential energy surface and a CCSD(T)/aug-cc-pVQZ a…

astro-ph.EP2019★ 33 cited

Identifiable Acetylene Features Predicted for Young Earth-like Exoplanets with Reducing Atmospheres undergoing Heavy Bombardment

P. B. Rimmer, M. Ferus, I. P. Waldmann +14

The chemical environments of young planets are assumed to be largely influenced by impacts of bodies lingering on unstable trajectories after the dissolution of the protoplanetary…

astro-ph.EP2019★ 281 cited

Water vapour in the atmosphere of the habitable-zone eight Earth-mass planet K2-18 b

Angelos Tsiaras, Ingo P. Waldmann, Giovanna Tinetti +2

In the past decade, observations from space and ground have found HO to be the most abundant molecular species, after hydrogen, in the atmospheres of hot, gaseous, extrasolar p…

astro-ph.EP2019★ 48 cited

ExoMol molecular line lists XXXVI: and transitions of SH

Maire N. Gorman, Sergei N. Yurchenko, Jonathan Tennyson

The GYT line list covering rotational, rovibrational and rovibronic transitions of the mercapto radical SH is presented. This work extends and replaces the SNaSH line list [Yurchen…

physics.comp-ph2019★ 168 cited

UKRmol+: a suite for modelling of electronic processes in molecules interacting with electrons, positrons and photons using the R-matrix method

Zdeněk Mašín, Jakub Benda, Jimena D. Gorfinkiel +2

UKRmol+ is a new implementation of the UK R-matrix electron-molecule scattering code. Key features of the implementation are the use of quantum chemistry codes such as Molpro to pr…