Environmental and complexation effects on the structures and spectroscopic signatures of organic pigments relevant for cultural heritage: the case of Alizarin and Alizarin-Mg(II)/A...

Por Carta, Luciano, Biczysko, Malgorzata, Bloino, Julien, Licari, Daniele, Barone, Vincenzo
Publicado no Phys Chem Chem Phys (2014)

VMS-ROT: A New Module of the Virtual Multifrequency Spectrometer for Simulation, Interpretation, and Fitting of Rotational Spectra

Por Licari, Daniele, Tasinato, Nicola, Spada, Lorenzo, Puzzarini, Cristina, Barone, Vincenzo
Publicado no J Chem Theory Comput (2017)