213 citations · 784 across the 17 of their papers we have counts for
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astro-ph.GA2022★ 17 cited
Probing computational methodologies in predicting mid-infrared spectra for large polycyclic aromatic hydrocarbons
Boutheïna Kerkeni, Ismael García-Bernete, Dimitra Rigopoulou +3
We extend the prediction of vibrational spectra to large sized polycyclic aromatic hydrocarbon (PAH) molecules comprising up to \sim 1500 carbon atoms by evaluating the efficiency…
quant-ph2022★ 3 cited
Exact electronic states with shallow quantum circuits through global optimisation
Hugh G. A. Burton, Daniel Marti-Dafcik, David P. Tew +1
Quantum computers promise to revolutionise electronic simulations by overcoming the exponential scaling of many-electron problems. While electronic wave functions can be represente…