Deep eutectic solvents (DESs) are one of the most rapidly evolving types of solvents,
appearing in a broad range of applications, such as nanotechnology, electrochemistry …

Abstract The Joint Automated Repository for Various Integrated Simulations (JARVIS) is an
integrated infrastructure to accelerate materials discovery and design using density …

Autonomous computations that rely on automated reaction network elucidation algorithms
may pave the way to make computational catalysis on a par with experimental research in …

The Cahn–Hilliard equation is commonly used to study multi-component soft systems such
as polymer blends at continuum scales. We first systematically explore various features of …

Lack of rigorous reproducibility and validation are significant hurdles for scientific
development across many fields. Materials science, in particular, encompasses a variety of …

Lack of rigorous reproducibility and validation are major hurdles for scientific development
across many fields. Materials science in particular encompasses a variety of experimental …

We present nucleation phase field model benchmark problems, expanding on our previous
benchmark problems on diffusion, precipitation, dendritic growth, linear elasticity, fluid flow …

Gate-defined quantum dots are a promising candidate system for realizing scalable, coupled
qubit systems and serving as a fundamental building block for quantum computers …

Phase field models are an important mesoscale method that serves as a bridge between the
atomic scale and the macroscale, used for modeling complex phenomena at the …

Gate-defined quantum dots are a promising candidate system to realize scalable, coupled
qubit systems and serve as a fundamental building block for quantum computers. However …