In Situ Kinetic Observations on Crystal Nucleation and Growth

J Li, FL Deepak - Chemical reviews, 2022 - ACS Publications
Nucleation and growth are critical steps in crystallization, which plays an important role in
determining crystal structure, size, morphology, and purity. Therefore, understanding the …

Ab initio calculation of hafnium and zirconium melting curves via the Lindemann criterion

DV Minakov, MA Paramonov, GS Demyanov, VB Fokin… - Physical Review B, 2022 - APS
In this work we present the melting curves of hafnium and zirconium obtained using
quantum molecular dynamics calculations. The mean-square displacements computed …

Optimized interatomic potential for atomistic simulation of Zr-Nb alloy

S Starikov, D Smirnova - Computational Materials Science, 2021 - Elsevier
We present a new classical interatomic potential for a study of the binary Zr-Nb system,
taking into account a wide range of the components concentrations. The potential was …

[HTML][HTML] Time resolved x-ray diffraction in shock compressed systems

HB Radousky, MR Armstrong, N Goldman - Journal of Applied Physics, 2021 - pubs.aip.org
The availability of pulsed x rays on short timescales has opened up new avenues of
research in the physics and chemistry of shocked materials. The continued installation of …

Highly ordered graphite (HOPG) to hexagonal diamond (lonsdaleite) phase transition observed on picosecond time scales using ultrafast x-ray diffraction

MR Armstrong, HB Radousky, RA Austin… - Journal of Applied …, 2022 - pubs.aip.org
The response of rapidly compressed highly oriented pyrolytic graphite (HOPG) normal to its
basal plane was investigated at a pressure of∼ 80 GPa. Ultrafast x-ray diffraction using∼ …

Probing extreme states of matter using ultra-intense x-ray radiation

MI McMahon - Journal of Physics: Condensed Matter, 2021 - iopscience.iop.org
Extreme states of matter, that is, matter at extremes of density (pressure) and temperature,
can be created in the laboratory either statically or dynamically. In the former, the pressure …

Ab initio inspection of thermophysical experiments for zirconium near melting

MA Paramonov, DV Minakov, VB Fokin… - Journal of Applied …, 2022 - pubs.aip.org
We present quantum molecular dynamics calculations of thermophysical properties of solid
and liquid zirconium in the vicinity of melting. An overview of available experimental data is …

[HTML][HTML] Coupling solidification kinetics with phase-behavior computations in hydrodynamic simulations of high-pressure, dynamic-compression processes

PC Myint, B Sadigh, LX Benedict, DM Sterbentz… - AIP Advances, 2020 - pubs.aip.org
In this study, we report a numerical scheme to integrate models for the kinetics of
solidification processes together with phase-behavior computations in the context of …

Femtosecond diffraction studies of the sodium chloride phase diagram under laser shock compression

V Rastogi, RF Smith, DC Swift, R Briggs… - Journal of Applied …, 2022 - pubs.aip.org
The phase diagram of sodium chloride (NaCl) under laser shock compression has been
studied at Linac Coherent Light Source (LCLS) at the x-ray free-electron laser facility. Both …

Dynamic x-ray diffraction and nanosecond quantification of kinetics of formation of -zirconium under shock compression

P Kalita, J Brown, P Specht, S Root, M White, JS Smith - Physical Review B, 2020 - APS
We report the atomic-and nanosecond-scale quantification of kinetics of a shock-driven
phase transition in Zr metal. We uniquely make use of a multiple shock-and-release loading …