activity
20112026
most citedGW quasiparticle band structures of stibnite, antimonselite, bismuthinite, and guanajuatite

217 citations · 1.2k across the 27 of their papers we have counts for

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Showing cond-mat.mtrl-sciShow all

26 papers · 1 filter

cond-mat.mtrl-sci2026

Fe-site-resolved anisotropy energies in NdFeB for atomistic spin dynamics

Veronica T. C. Lai, Christopher E. Patrick

Nd-Fe-B magnets are the most widely used high performance magnets in the world today, and remain the subject of both experimental and computational research aimed at understanding…

cond-mat.mtrl-sci2023

Theory of defect-induced crystal field perturbations in rare earth magnets

Christopher E. Patrick, Yixuan Huang, Laura H. Lewis +1

We present a theory describing the single-ion anisotropy of rare earth (RE) magnets in the presence of point defects. Taking the RE-lean 1:12 magnet class as a prototype, we use fi…

cond-mat.mtrl-sci2023★ 33 cited

Revisiting Néel 60 years on: the magnetic anisotropy of FeNi (tetrataenite)

Christopher D. Woodgate, Christopher E. Patrick, Laura H. Lewis +1

The magnetocrystalline anisotropy energy of atomically ordered FeNi (the meteoritic mineral tetrataenite) is studied within a first-principles electronic structure…

cond-mat.mtrl-sci2023★ 7 cited

Quantification of electronic and magnetoelastic mechanisms of first-order magnetic phase transitions from first principles: application to caloric effects in La(FeSi)

Eduardo Mendive Tapia, Christopher E. Patrick, Tilmann Hickel +2

La(FeSi) and derived quaternary compounds are well-known for their giant, tunable, magneto- and barocaloric responses around a first-order paramagnetic-ferromagn…

cond-mat.mtrl-sci2023★ 20 cited

Crucial role of Fe in determining the hard magnetic properties of NdFeB

Juba Bouaziz, Christopher E. Patrick, Julie B. Staunton

NdFeB's unsurpassed, hard magnetic properties for a wide range of temperatures result from a combination of a large volume magnetization from Fe and a strong single-ion…

cond-mat.mtrl-sci2020★ 16 cited

Spin orientation and magnetostriction of TbDyFe from first principles

Christopher E. Patrick, George A. Marchant, Julie B. Staunton

The optimal amount of dysprosium in the highly magnetostrictive rare-earth compounds TbDyFe for room temperature applications has long been known to be =0.73 (Te…