362 citations · 1.9k across the 27 of their papers we have counts for
27 papers
A Local Structural Basis to Resolve Amorphous Ices
Quinn M. Gallagher, Ryan J. Szukalo, Nicolas Giovambattista +2
Phases with distinct thermodynamic properties must differ in their underlying microscopic configurations. While ordered phases are readily distinguished by unit cells and space gro…
Configurational Entropy and Adam-Gibbs Relation for Quantum Liquids
Yang Zhou, Ali Eltareb, Gustavo E. Lopez +1
As a liquid approaches the glass state, its dynamics slows down rapidly, by a few orders of magnitude in a very small temperature range. In the case of light elements and small mol…
Supercritical density fluctuations and structural heterogeneity in supercooled water-glycerol microdroplets
Sharon Berkowicz, Iason Andronis, Anita Girelli +9
Recent experiments and theoretical studies strongly indicate that water exhibits a liquid-liquid phase transition (LLPT) in the supercooled domain. An open question is how the LLPT…
Potential Energy Landscape of a Flexible Water Model: Equation-of-State, Configurational Entropy, and Adam-Gibbs Relationship
Ali Eltareb, Gustavo E. Lopez, Nicolas Giovambattista
The potential energy landscape (PEL) formalism is a tool within statistical mechanics that has been used in the past to calculate the equation of states (EOS) of classical rigid mo…
Liquid-liquid phase transition in simulations of ultrafast heating and decompression of amorphous ice
Nicolas Giovambattista, Peter H. Poole
A recent experiment [K. H. Kim, et al., Science 370, 978 (2020)] showed that it may be possible to detect a liquid-liquid phase transition (LLPT) in supercooled water by subjecting…
Glass Polymorphism in TIP4P/2005 Water: A Description Based on the Potential Energy Landscape Formalism
Philip H. Handle, Francesco Sciortino, Nicolas Giovambattista
The potential energy landscape (PEL) formalism is a statistical mechanical approach to describe supercooled liquids and glasses. Here we use the PEL formalism to study the pressure…