Precipitate shearing, fault energies, and solute segregation to planar faults in Ni-, CoNi-, and Co-base superalloys
YM Eggeler, KV Vamsi… - Annual Review of Materials …, 2021 - annualreviews.org
The mechanical properties of superalloys are strongly governed by the resistance to
shearing of ordered precipitates by dislocations. In the operating environments of …
shearing of ordered precipitates by dislocations. In the operating environments of …
First-principles statistical mechanics of multicomponent crystals
The importance of configurational, vibrational, and electronic excitations in crystalline solids
of technological interest makes a rigorous treatment of thermal excitations an essential …
of technological interest makes a rigorous treatment of thermal excitations an essential …
Evolution of the conductive filament system in HfO2-based memristors observed by direct atomic-scale imaging
The resistive switching effect in memristors typically stems from the formation and rupture of
localized conductive filament paths, and HfO2 has been accepted as one of the most …
localized conductive filament paths, and HfO2 has been accepted as one of the most …
Layered Cathode Materials for Lithium-Ion Batteries: Review of Computational Studies on LiNi1–x–yCoxMnyO2 and LiNi1–x–yCoxAlyO2
At present the most successful rechargeable battery is the Li-ion battery, due to the small
size, high energy density, and low reduction potential of Li. Computational materials science …
size, high energy density, and low reduction potential of Li. Computational materials science …
Origin of the low conversion efficiency in Cu 2 ZnSnS 4 kesterite solar cells: the actual role of cation disorder
The controversial role of cation disorder in the extraordinarily low open-circuit voltage (VOC)
of the Cu2ZnSnS4 (CZTS) kesterite absorber is examined through a statistical treatment of …
of the Cu2ZnSnS4 (CZTS) kesterite absorber is examined through a statistical treatment of …
Phase behavior in rhombohedral NaSiCON electrolytes and electrodes
The replacement of the presently used liquid electrolytes by a nonflammable solid
electrolytes is an important avenue to create safer batteries. The natrium superionic …
electrolytes is an important avenue to create safer batteries. The natrium superionic …
[PDF][PDF] 5.03 corrosion of zirconium alloys
Zirconium alloys are widely used for fuel cladding and in pressure tubes, fuel channels
(boxes), and fuel spacer grids in almost all water-cooled reactors: light water reactors such …
(boxes), and fuel spacer grids in almost all water-cooled reactors: light water reactors such …
Prediction of structure and cation ordering in an ordered normal-inverse double spinel
Spinels represent an important class of technologically relevant materials, used in diverse
applications ranging from dielectrics, sensors and energy materials. While solid solutions …
applications ranging from dielectrics, sensors and energy materials. While solid solutions …
[HTML][HTML] Development of process parameters for selective laser melting of a Zr-based bulk metallic glass
Parameters for selective laser melting of Zr 59.3 Cu 28.8 Al 10.4 Nb 1.5 (trade name AMZ4),
allowing crack-free bulk metallic glass with low porosity, have been developed. The phase …
allowing crack-free bulk metallic glass with low porosity, have been developed. The phase …
Machine learning materials physics: Integrable deep neural networks enable scale bridging by learning free energy functions
GH Teichert, AR Natarajan, A Van der Ven… - Computer Methods in …, 2019 - Elsevier
The free energy of a system is central to many material models. Although free energy data is
not generally found directly, its derivatives can be observed or calculated. In this work, we …
not generally found directly, its derivatives can be observed or calculated. In this work, we …