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Lista de obras de Lucas Modesto-Costa

Calculations of the spectral shifts and line profiles of alkaline earth atoms in liquid helium environment

Combining Monte Carlo simulation and density-functional theory to describe the spectral changes of Na2in liquid helium

article by Lucas Modesto-Costa et al published 25 April 2011 in Physical Review A

Discrete and continuum modeling of solvent effects in a twisted intramolecular charge transfer system: The 4-N,N-dimethylaminobenzonitrile (DMABN) molecule

scientific article published on 30 April 2018

Electronic structure theory gives insights into the higher efficiency of the PTB electron-donor polymers for organic photovoltaics in comparison with prototypical P3HT

scientific article published on 01 November 2018

Elucidating the mass spectrum of the retronecine alkaloid using DFT calculations

artículo científico publicado en 2018

Microwave effects on NiMoS and CoMoS single-sheet catalysts

artículo científico publicado en 2018

Molecular dynamics simulation of the electron ionization mass spectrum of tabun

artículo científico publicado en 2020

Understanding the Stokes shift and nonlinear optical behavior of 1-nitro-2-phenylethane: A sequential Monte Carlo/Quantum Mechanics discussion

scientific article published in 2022

Water solvent effects using continuum and discrete models: The nitromethane molecule, CH3NO2.

artículo científico publicado en 2015

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