Search filters

List of works by Ana Lilian Montero-Alejo

Alternative CNDOL Fockians for fast and accurate description of molecular exciton properties

scientific article published on 3 June 2024

CNDOL: A fast and reliable method for the calculation of electronic properties of very large systems. Applications to retinal binding pocket in rhodopsin and gas phase porphine.

scientific article published in October 2007

Electronic excitations of C60 aggregates.

scientific article published in October 2012

Multi-scale simulation reveals that an amino acid substitution increases photosensitizing reaction inputs in Rhodopsins

scientific article published on 05 August 2020

Similarity measures between excited singlet and triplet electron densities in linear acenes: an application to singlet fission

Sulfur dimers adsorbed on Au(111) as building blocks for sulfur octomers formation: A density functional study

scientific article published on 01 July 2014

Synthesis of 5-acetoxymethyl- and 5-hydroxymethyl-2-vinyl-furan

scientific article published on 26 March 2007

Theoretical study of chlordecone and surface groups interaction in an activated carbon model under acidic and neutral conditions

scientific article

Theoretical study of γ-hexachlorocyclohexane and β-hexachlorocyclohexane isomers interaction with surface groups of activated carbon model.

scientific article published on 27 May 2014

Ultrathin carbon nanotube with single, double, and triple bonds

scientific article published on 04 September 2012

Understanding rhodopsin mutations linked to the retinitis pigmentosa disease: a QM/MM and DFT/MRCI study.

scientific article published on 13 January 2012

Paulina is supported by:

About Paulina

Help