71 citations · 155 across the 7 of their papers we have counts for
17 papers
SnPS: A Promising Infrared Nonlinear Optical Crystal with Strong Non-Resonant Second Harmonic Generation and Phase-matchability
Jingyang He, Seng Huat Lee, Francesco Naccarato +10
High-power infrared laser systems with broadband tunability are of great importance due to their wide range of applications in spectroscopy and free-space communications. These sys…
First principles study of the T-center in Silicon
Diana Dhaliah, Yihuang Xiong, Alp Sipahigil +2
The T-center in silicon is a well-known carbon-based color center that has been recently considered for quantum technology applications. Using first principles computations, we sho…
OPTIMADE, an API for exchanging materials data
Casper W. Andersen, Rickard Armiento, Evgeny Blokhin +53
The Open Databases Integration for Materials Design (OPTIMADE) consortium has designed a universal application programming interface (API) to make materials databases accessible an…
Visualizing Temperature-Dependent Phase Stability in High Entropy Alloys
Daniel Evans, Jiadong Chen, Geoffroy Hautier +1
High Entropy Alloys (HEAs) contain near equimolar amounts of five or more elements and are a compelling space for materials design. Great emphasis is placed on identifying HEAs tha…
Structure motif centric learning framework for inorganic crystalline systems
Huta R. Banjade, Sandro Hauri, Shanshan Zhang +4
Incorporation of physical principles in a network-based machine learning (ML) architecture is a fundamental step toward the continued development of artificial intelligence for mat…
Combining phonon accuracy with high transferability in Gaussian approximation potential models
Janine George, Geoffroy Hautier, Albert P. Bartók +2
Machine learning driven interatomic potentials, including Gaussian approximation potential (GAP) models, are emerging tools for atomistic simulations. Here, we address the methodol…