DFT+渭: Density Functional Theory for Muon Site Determination
(2023)
How to be a quantum mechanic
Contemporary Physics Taylor & Francis 64:3 (2023) 251-251
DFT plus 渭: Density functional theory for muon site determination
APPLIED PHYSICS REVIEWS AIP Publishing 10:2 (2023) 21316
Abstract:
The technique of muon spin rotation (渭SR) has emerged in the last few decades as one of the most powerful methods of obtaining local magnetic information. To make the technique fully quantitative, it is necessary to have an accurate estimate of where inside the crystal structure the muon implants. This can be provided by density functional theory calculations using an approach that is termed as DFT + 渭, density functional theory with the implanted muon included. This article reviews this approach, describes some recent successes in particular 渭SR experiments, and suggests some avenues for future exploration.Magnetostriction-Driven Muon Localization in an Antiferromagnetic Oxide
(2023)
Beyond single tetrahedron physics of the breathing pyrochlore compound Ba3Yb2Zn5O11
Physical Review B American Physical Society 107:14 (2023) L140408