1-8 of 8
Carla Molteni
Close
Save search
Follow your search
Access your saved searches in your account
Close Modal
Sort by
Journal Articles

Unveiling the face-dependent ice growth kinetics: Insights from molecular dynamics on the basal and prism surfaces

Open Access
Jihong Shi, Maxwell Fulford, Matteo Salvalaglio, Carla Molteni
Journal: The Journal of Chemical Physics
J. Chem. Phys. 162, 054714 (2025)
https://doi.org/10.1063/5.0240795
Published: February 2025
View articletitled, Unveiling the face-dependent ice growth kinetics: Insights from molecular dynamics on the basal and prism surfaces
Open the PDF for Unveiling the face-dependent ice growth kinetics: Insights from molecular dynamics on the basal and prism surfaces in another window
Journal Articles

Cholesterol content in the membrane promotes key lipid-protein interactions in a pentameric serotonin-gated ion channel

Available to Purchase
Alessandro Crnjar, Carla Molteni
Journal: Biointerphases
Biointerphases 15, 061018 (2020)
https://doi.org/10.1116/6.0000561
Published: January 2021
View articletitled, Cholesterol content in the membrane promotes key lipid-protein interactions in a pentameric serotonin-gated ion channel
Open the PDF for Cholesterol content in the membrane promotes key lipid-protein interactions in a pentameric serotonin-gated ion channel in another window
Includes: Supplementary data
Journal Articles

Mapping the conformational free energy of aspartic acid in the gas phase and in aqueous solution

Open Access
Federico Comitani, Kevin Rossi, Michele Ceriotti, M. Eugenia Sanz, Carla Molteni
Journal: The Journal of Chemical Physics
J. Chem. Phys. 146, 145102 (2017)
https://doi.org/10.1063/1.4979519
Published: April 2017
View articletitled, Mapping the conformational free energy of aspartic acid in the gas phase and in aqueous solution
Open the PDF for Mapping the conformational free energy of aspartic acid in the gas phase and in aqueous solution in another window
Journal Articles

Simulations of nanocrystals under pressure: Combining electronic enthalpy and linear-scaling density-functional theory

Open Access
Niccolò R. C. Corsini, Andrea Greco, Nicholas D. M. Hine, Carla Molteni, Peter D. Haynes
Journal: The Journal of Chemical Physics
J. Chem. Phys. 139, 084117 (2013)
https://doi.org/10.1063/1.4819132
Published: August 2013
View articletitled, Simulations of nanocrystals under pressure: Combining electronic enthalpy and linear-scaling density-functional theory
Open the PDF for Simulations of nanocrystals under pressure: Combining electronic enthalpy and linear-scaling density-functional theory in another window
Journal Articles

Pressure-induced structural phase transitions in CdSe: A metadynamics study

Available to Purchase
Clive Bealing, Roman Martoňák, Carla Molteni
Journal: The Journal of Chemical Physics
J. Chem. Phys. 130, 124712 (2009)
https://doi.org/10.1063/1.3086043
Published: March 2009
View articletitled, Pressure-induced structural phase transitions in CdSe: A metadynamics study
Open the PDF for Pressure-induced structural phase transitions in CdSe: A metadynamics study in another window
Journal Articles

In-plane structure and ordering at liquid sodium surfaces and interfaces from ab initio molecular dynamics

Available to Purchase
Brent G. Walker, Nicola Marzari, Carla Molteni
Journal: The Journal of Chemical Physics
J. Chem. Phys. 127, 134703 (2007)
https://doi.org/10.1063/1.2781388
Published: October 2007
View articletitled, In-plane structure and ordering at liquid sodium surfaces and interfaces from ab initio molecular dynamics
Open the PDF for In-plane structure and ordering at liquid sodium surfaces and interfaces from ab initio molecular dynamics in another window
Journal Articles

Ab initio studies of layering behavior of liquid sodium surfaces and interfaces

Available to Purchase
Brent G. Walker, Nicola Marzari, Carla Molteni
Journal: The Journal of Chemical Physics
J. Chem. Phys. 124, 174702 (2006)
https://doi.org/10.1063/1.2187484
Published: May 2006
View articletitled, Ab initio studies of layering behavior of liquid sodium surfaces and interfaces
Open the PDF for Ab initio studies of layering behavior of liquid sodium surfaces and interfaces in another window
Journal Articles

Modeling Complex Systems From First Principles: From Nanocrystals to Biomolecules

Free
Carla Molteni
Journal: AIP Conference Proceedings
AIP Conf. Proc. 795, 211 (2005)
https://doi.org/10.1063/1.2128355
Published: October 2005
View articletitled, Modeling Complex Systems From First Principles: From Nanocrystals to Biomolecules
Open the PDF for Modeling Complex Systems From First Principles: From Nanocrystals to Biomolecules in another window