Publication

Early Stages of Precipitation In Aluminum Alloys by First-Principles and Machine-Learning Atomistic Simulations

Publications associées (102)

Linking electronic structure calculations to generalized stacking fault energies in multicomponent alloys

The generalized stacking fault energy is a key ingredient to mesoscale models of dislocations. Here we develop an approach to quantify the dependence of generalized stacking fault energies on the degree of chemical disorder in multicomponent alloys. We int ...

Springer Nature2020

Combining alloy and process modification for micro-crack mitigation in an additively manufactured Ni-base superalloy

Roland Logé, Christian Leinenbach, Jamasp Jhabvala, Xavier Maeder, Hossein Ghasemi Tabasi, Toni Ivas, Rafal Wróbel

The additive manufacturing (AM) of the gamma' precipitation strengthened Ni-base superalloys still remains a challenge due to their susceptibility to micro-cracking. Post-processing, such as HIPing, has been shown to heal the micro-cracks but it remains de ...

ELSEVIER2020

Combining experiments and modeling to explore the solid solution strengthening of high and medium entropy alloys

William Curtin, Céline Varvenne

The mechanical properties due to solid solution strengthening are explored within the single phase face-centered cubic (fcc) domain of the Co-Cr-Fe-Mn Ni high entropy alloy (HEA) system. This is achieved by combining an efficient and reproducible metallurg ...

2019

Stability and strain-driven evolution of β′ precipitate in Mg-Y alloys

Anirudh Raju Natarajan

Alloying Mg with rare-earth elements, such as Nd, Gd, or Y, enables hardening from the precipitation of metastable coherent phases during aging at low temperatures. While the aging potential of binary Mg-Nd alloys is relatively limited due to the nucleatio ...

Elsevier2019

First-principles-based prediction of yield strength in the RhIrPdPtNiCu high-entropy alloy

William Curtin, Binglun Yin

High-entropy alloys are random alloys with five or more components, often near equi-composition, that often exhibit excellent mechanical properties. Guiding the design of new materials across the wide composition space requires an ability to compute necess ...

2019

Enhanced precipitate growth at reduced temperatures during chemical ordering in deformed red gold alloys

Helena Van Swygenhoven, Steven Van Petegem, Nadine Baluc, Marina Garcia Gonzalez, Samy Hocine

Manufacturing of red gold components relies widely on controlling the formation of ordered precipitates during thermo-mechanical processing. The ordered phase hardens the material, makes it less workable and introduces residual stresses. We show that an in ...

PERGAMON-ELSEVIER SCIENCE LTD2019

Atomistic-continuum coupling of random alloys

William Curtin, Till Junge, Shankha Nag

Random alloys are multicomponent systems where the atomic type on each lattice site is independent of the atom types on any other lattice site. The fluctuations in local atomic configurations inherent to the random alloy prevents the accurate application o ...

IOP PUBLISHING LTD2019

Healing cracks in selective laser melting by 3D laser shock peening

Roland Logé, Christian Leinenbach, Jamasp Jhabvala, Nikola Kalentics, Navid Sohrabi, Hossein Ghasemi Tabasi, Andreas Burn

Selective Laser Melting (SLM) of Ni-based superalloys such as CM247LC is prone to weld-cracking. This paper investigates how to suppress cracks by repeatedly applying Laser Shock Peening (LSP) during the building phase of SLM. Samples made of CM247LC were ...

ELSEVIER2019

Thermal activation parameters of plastic flow reveal deformation mechanisms in the CrMnFeCoNi high-entropy alloy

William Curtin, Céline Varvenne, Joël Bonneville

To reveal the operating mechanisms of plastic deformation in an FCC high-entropy alloy, the activation volumes in CrMnFeCoNi have been measured as a function of plastic strain and temperature between 77 K and 423 K using repeated load relaxation experiment ...

2018

Dislocation Cross-Slip in Face-Centered Cubic Solid Solution Alloys

Wolfram Georg Nöhring

The mechanical strength of metals depends on their resistance against various microscopic deformation processes. In ductile metals, the most important process is shearing of the crystal lattice by dislocations. One of the fundamental aspects of dislocation ...

EPFL2018

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