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Molinero
Research
Group

fragment of The Great Wave off Kanagawa by Hokusai

 


We investigate the interplay between microscopic structure, dynamics and phase transformations in materials using computer simulations and theory

water and solutions • ices • clathrates • crystallization • biological ice nucleation • amorphous ices • shear-driven transformations • silica • synthesis of zeolites and porous crystals • mesophases • fuel cell membranes • ion and water transport • water uptake • electrochemically generated nanobubbles • electrocatalysis • coarse-grained models • molecular dynamics • monte carlo • kinetic monte carlo 


 

Recent Publications

 


Medium Density Amorphous Unveils Shear-Rate as a New Dimension in Water’s Phase Diagram

I. de Almeida Ribeiro, D. Dhabal, R. Kumar, S. Banik, S. Sankaranarayanan, and V. Molinero

PNAS (2024)

 

 

 


Interzeolite Transformation Through Cross-Nucleation: A Molecular Mechanisms for Seed-Assisted Synthesis

C. Chu-Jon, A. A. Bertolazzo, S. Banik, J. D. Rimer, S.K.R.S. Sankaranarayanan, and V. Molinero

JACS (2024)

 

 



Hierarchical Assembly and Environmental Enhancement of Bacterial Ice Nucleators

G. Renzer, I. de Almeida Ribeiro, H.-B. Guo, J. Fröhlich-Nowoisky, R. Berry, M. Bonn, V. Molinero, and K. Meister

PNAS (2024)

 

 

 

 


The Smallest Electrochemical Bubbles

E. D. Gadea*, Y. Perez Sirkin, V. Molinero*, D. A. Scherlis

PNAS (2024)

 

The Molinero research group gratefully acknowledges its current and past sponsors

NSF logo
ARL logo
Arnold and Mabel Beckman Foundation logo
The Camille and Henry Dreyfus Foundation, Inc. logo
CHPC logo
Agencia logo
Myriad logo
AFOSR logo
DOE Office of Science logo
University of Utah logo
Last Updated: 12/16/24