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Journal of Chemical Theory and Computation|November 21, 2015
Characterizing and Understanding Divalent Adsorbates on Carbon Nanotubes with Ab Initio and Classical Approaches: Size, Chirality, and Coverage EffectsJaap M H Kroes, Fabio Pietrucci, Alessandro Curioni, et al.The Journal of Physical Chemistry. B|March 12, 2014
DFT-derived reactive potentials for the simulation of activated processes: the case of CdTe and CdTe:SXiao Liang Hu, Riccardo Ciaglia, Fabio Pietrucci, et al.Journal of Chemical Theory and Computation|November 18, 2015
Atom Vacancies on a Carbon Nanotube: To What Extent Can We Simulate their Effects?Jaap M H Kroes, Fabio Pietrucci, Adri C T van Duin, et al.Journal of Chemical Theory and Computation|December 1, 2015
A Collective Variable for the Efficient Exploration of Protein Beta-Sheet Structures: Application to SH3 and GB1Fabio Pietrucci, Alessandro LaioThe Journal of Chemical Physics|March 16, 2015
Systematic comparison of crystalline and amorphous phases: Charting the landscape of water structures and transformationsFabio Pietrucci, Roman MartoňákPhysical Review. E|February 17, 2023
Critical comparison of general-purpose collective variables for crystal nucleationJulien Lam, Fabio PietrucciJournal of Chemical Theory and Computation|July 28, 2022
Free Energy Landscapes, Diffusion Coefficients, and Kinetic Rates from Transition PathsKaren Palacio-Rodriguez, Fabio PietrucciProceedings of the National Academy of Sciences of the United States of America|November 25, 2015
Formamide reaction network in gas phase and solution via a unified theoretical approach: Toward a reconciliation of different prebiotic scenariosFabio Pietrucci, Antonino Marco SaittaThe Journal of Chemical Physics|August 24, 2013
Structural cluster analysis of chemical reactions in solutionGrégoire A Gallet, Fabio PietrucciThe Journal of Chemical Physics|October 16, 2021
Impurity diffusion in magic-size icosahedral clustersDiana Nelli, Fabio Pietrucci, Riccardo FerrandoPageof 8