J. Neugebauer

most citedQuantification of electronic and magnetoelastic mechanisms of first-order magnetic phase transitions from first principles: application to caloric effects in La(Fe

_{x}

_{1 - x}

)

_{13}

7 citations · 7 across the 3 of their papers we have counts for

collaborators

3 papers

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(Fe $_{x}$ Si $_{1 - x}$ ) $_{13}$

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

La(Fe $_{x}$ Si $_{1 - x}$ ) $_{13}$ and derived quaternary compounds are well-known for their giant, tunable, magneto- and barocaloric responses around a first-order paramagnetic-ferromagn…

cond-mat.mtrl-sci2022

Effect of Sn on generalized stacking fault energy surfaces in zirconium and its hydrides

P. Chakraborty, I. Mouton, B. Gault +3

Hydrogen embrittlement in Zr alloy fuel cladding is a primary safety concern for water based nuclear reactors. Here we investigated the stabilisation of planar defects within the f…

cond-mat.mtrl-sci2022

Controlled doping of electrocatalysts through engineering impurities

Se-Ho Kim, Su-Hyun Yoo, Sangyong Shin +9

Fuel cells recombine water from H2 and O2 thereby powering e.g. cars or houses with no direct carbon emission. In anion-exchange membrane fuel cells (AEMFCs), to reach high power d…

Quantification of electronic and magnetoelastic mechanisms of first-order magnetic phase transitions from first principles: application to caloric effects in La(Fex​Si1−x​)13​

Effect of Sn on generalized stacking fault energy surfaces in zirconium and its hydrides

Controlled doping of electrocatalysts through engineering impurities

Quantification of electronic and magnetoelastic mechanisms of first-order magnetic phase transitions from first principles: application to caloric effects in La(Fe $_{x}$ Si $_{1 - x}$ ) $_{13}$