Roberto Cammi (R Cammi)

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 16

Top Topics

Molecular Dynamics Simulations

Top Venues

Journal of computational chemistry

Chemical science

The Journal of chemical physics

Physical chemistry chemical physics : PCCP

This page only lists publications with an associated author ORCID identifier.

Publications

Marina Tesi, Roberto Cammi, Giovanni Granucci, Maurizio Persico
An algorithm for very high pressure molecular dynamics simulations. Journal of computational chemistry (2024)
Takafumi Shiraogawa, Giulia Dall'Osto, Roberto Cammi, Masahiro Ehara, Stefano Corni
Inverse design of molecule-metal nanoparticle systems interacting with light for desired photophysical properties. Physical chemistry chemical physics : PCCP 24 (37) (2022)
Bo Chen, Kendall N Houk, Roberto Cammi
High-Pressure Reaction Profiles and Activation Volumes of 1,3-Cyclohexadiene Dimerizations Computed by the Extreme Pressure-Polarizable Continuum Model (XP-PCM). Chemistry (Weinheim an der Bergstrasse, Germany) 28 (29) (2022)
Roberto Cammi, Bo Chen
The second derivative of the electronic energy with respect to the compression scaling factor in the XP-PCM model: Theory and applications to compression response functions of atoms. Journal of computational chemistry 43 (17) (2022)
Jochen Eeckhoudt, Tom Bettens, P Geerlings, Roberto Cammi, Bo Chen, Mercedes Alonso, Frank de Proft
Conceptual density functional theory under pressure: Part I. XP-PCM method applied to atoms. Chemical science 13 (32) (2022)
Martin Rahm, Roberto Cammi, N W Ashcroft, Roald Hoffmann
Correction to "Squeezing All Elements in the Periodic Table: Electron Configuration and Electronegativity of the Atoms under Compression". Journal of the American Chemical Society 143 (28) (2021)
Matteo Boccalini, Roberto Cammi, Marco Pagliai, Gianni Cardini, Vincenzo Schettino
Toward an Understanding of the Pressure Effect on the Intramolecular Vibrational Frequencies of Sulfur Hexafluoride. The journal of physical chemistry. A 125 (29) (2021)
Martin Rahm, Paul Erhart, Roberto Cammi
Relating atomic energy, radius and electronegativity through compression. Chemical science 12 (7) (2021)
Scott G Stewart, Gwion J Harfoot, Kenneth J McRae, Yinglai Teng, Li-Juan Yu, Bo Chen, Roberto Cammi, Michelle L Coote, Martin G Banwell, Anthony C Willis
High-Pressure-Promoted and Facially Selective Diels-Alder Reactions of Enzymatically Derived cis-1,2-Dihydrocatechols and Their Acetonide Derivatives: Enantiodivergent Routes to Homochiral and Polyfunctionalized Bicyclo[2.2.2]octenes. The Journal of organic chemistry 85 (20) (2020)
Roberto Cammi, Martin Rahm, Roald Hoffmann, N W Ashcroft
Varying Electronic Configurations in Compressed Atoms: From the Role of the Spatial Extension of Atomic Orbitals to the Change of Electronic Configuration as an Isobaric Transformation. Journal of chemical theory and computation 16 (8) (2020)
Martin Rahm, Mattias Ångqvist, J Magnus Rahm, Paul Erhart, Roberto Cammi
Non-Bonded Radii of the Atoms Under Compression. Chemphyschem : a European journal of chemical physics and physical chemistry 21 (21) (2020)
Roberto Cammi
The Role of Computational Chemistry in the Experimental Determination of the Dipole Moment of Molecules in Solution. Journal of computational chemistry 40 (26) (2019)
Marta Rosa, Gabriel Gil, Stefano Corni, Roberto Cammi
Quantum optimal control theory for solvated systems. The Journal of chemical physics 151 (19) (2019)
Roberto Cammi, Bo Chen, Martin Rahm
Analytical calculation of pressure for confined atomic and molecular systems using the eXtreme-Pressure Polarizable Continuum Model. Journal of computational chemistry 39 (26) (2018)
Silvio Pipolo, Stefano Corni, Roberto Cammi
Equation of motion for the solvent polarization apparent charges in the polarizable continuum model: Application to time-dependent CI. The Journal of chemical physics 146 (6) (2018)
Bo Chen, Roald Hoffmann, Roberto Cammi
The Effect of Pressure on Organic Reactions in Fluids-a New Theoretical Perspective. Angewandte Chemie (International ed. in English) 56 (37) (2017)