7.2k citations
- California Institute of TechnologyUS981 papers
- Centre National de la Recherche ScientifiqueFR846 papers
- Massachusetts Institute of TechnologyUS831 papers
- Princeton UniversityUS729 papers
- University of Maryland, College ParkUS710 papers
- Fermi National Accelerator LaboratoryUS703 papers
- University of California, DavisUS690 papers
- Johns Hopkins UniversityUS688 papers
- University of Wisconsin–MadisonUS659 papers
- Rutgers, The State University of New JerseyUS638 papers
- The Ohio State UniversityUS638 papers
- Cornell UniversityUS630 papers
241 papers · 1 filter
Electrochemical and thermal control of continuous phase transitions in P2-NaxNi1/3Mn2/3O2
Dylan A. Edelman, John Cattermull, Jue Liu +7
Sodium layered oxides often undergo phase transformations involving ordering or disordering of Na+ upon desodiation, i.e., when cycled as a battery electrode. Accurately characteri…
Atomistic and data-driven insights into the local slip resistances in random refractory multi-principal element alloys
Wu-Rong Jian, Arjun S. Kulathuvayal, Hanfeng Zhai +5
Refractory multi-principal element alloys (RMPEAs) have attracted growing interest for their exceptional high-temperature strength, yet their complex compositions hinder a mechanis…
Resonant states and nuclear dynamics in solid-state systems: the case of silicon-hydrogen bond dissociation
Woncheol Lee, Mark E. Turiansky, Dominic Waldhör +3
Bond breaking in the presence of highly energetic carriers is central to many important phenomena in physics and chemistry, including radiation damage, hot-carrier degradation, act…
Electric-Field-Dependent Thermal Conductivity in Fresh and Aged Bulk Single Crystalline
Fanghao Zhang, Guanchun Rui, Yujie Quan +4
Active thermal management requires advances in thermal switching materials, whose thermal conductivity responds to external stimuli. The electric field, as one of the most convenie…
Effect of Concentration Fluctuations on Material Properties of Disordered Alloys
Han-Pu Liang, Chuan-Nan Li, Xin-Ru Tang +4
Alloying compound AX with another compound BX is widely used to tune material properties. For disordered alloys, due to the lack of periodicity, it has been challenging to calculat…
A CN complex as an alternative to the T center in Si
J. K. Nangoi, M. E. Turiansky, C. G. Van de Walle
We present a first-principles study of a carbon-nitrogen (CN) impurity complex in silicon as an isoelectronic alternative to the T center [(CCH)]. The latter has been…