| Presenter | Title |
1
| Didarul Alam | The role of electron-electron correlations in the high harmonic generation in solids
|
2
| Kat Nykiel | Exploration of stacked MXenes as precursors to ultra-high temperature ceramics
|
3
| Jia Shi | Intra- and intervalley excitons in monolayer WSe2: A time-dependent density-functional theory analysis
|
4
| Hrushikesh Sahasrabuddhe
| An efficient high-throughput approach for investigating anharmonic lattice dynamics
|
5
| Bariana Bowman
| Electronic properties of SmB6
|
6
| Benjamin Geisler | Structural phase diagram and optical properties of superconducting bilayer nickelates under high pressure
|
7
| Bhawna Sahni | Efficient ab initio electronic transport computations in half-Heuslers: The example of NbFeSb
|
8
| Laura Pätzold | Downfolding approach to the coupling of electronic and nuclear degrees of freedom in systems with strong electron correlations
|
9
| Emily Cook | Electronic structure predictions in In- and Sn-doped CdO
|
10
| Joshua Townsend | Ferroelectric phases and phase transitions in CsGeBr3 induced by mechanical load
|
11
| Sohang Kundu | Ab initio nonadiabatic electron transfer at metal surfaces
|
12
| Matteo Rinaldi | Towards the construction of machine-learned interatomic potentials for polarons
|
13
| Jingyang You | Electron-phonon coupling phenomena in superconductors using GW and GW perturbation theory approaches
|
14
| Mohammadreza Nouri | Electron tunneling at electrocatalytic interfaces
|
15
| Pierre Lechifflart | First-principles study of luminescence in hexagonal boron nitride single layer: Exciton-phonon coupling and the role of substrate
|
16
| Chih-en Hsu | First-principles many-body perturbation theory studies of electron-electron and electron-phonon interactions in complex materials
|
17
| Katherine Pettersen | Optical properties of photosynthetic molecules from first-principles many-body perturbation theory
|
18
| Kamil Iwanowski | Entropy in the bond topology controls thermal conductivity of disordered polymorphs
|
19
| Surasree Sadhukhan | Spin-orbit coupling tuned crossover of gaped and gapless topological phases in the chalcopyrite HgSnX2(X=N/P)
|
20
| Ming-Chung Jiang | Possible rattling and anharmonicity enhanced superconductivity in Sc6MTe2 (M=Fe, Co, Ni)
|
21
| Daniel Khodachenko | Implementation of Nevanlinna analytic continuation in the EPW code
|
22
| Raagya Arora | Computational exploration of stable 2D ultra-wide bandgap hexagonal group III-nitride alloys
|
23
| Guo-Dong Zhao | Complex domain walls in HfO2 and the polarization description of successive ferroelectric switching
|
24
| Cristobal Vallejos | Memory effects in the energy dissipation of anharmonic solids
|
25
| Zhiren He | Optical control of ferroaxial order
|
26
| Zhenfa Zheng | Ab initio real-time quantum dynamics of charge carriers in momentum space
|
27
| Mario Galante | A self-consistent treatment of electron-phonon interaction and spin-orbit coupling in spin transport in chiral peptides
|
28
| Abdulijelili Popoola | Ferroelectric-photovoltaic co-functionality in CsGeI3
|
29
| Syeda Sherazi | Role of oxide support in stabilizing Ag single atom catalyst and subsequent NH3 adsorption
|
30
| Paromita Dutta | Lattice instabilities and electronic correlations in laminated Cr based MBenes and MXenes
|
| 31 | Aleksandr Poliukhin | Electron-phonon interactions beyond DFT
|
| 32 | Zien Zhu | Self-energy effects in electron-phonon coupling of MgB2
|
| 33 | Jameela Fatheema | Investigating the Switching Energy of 2D monolayer MoS 2 with Gold using DFT
|
| 34 | Eva Kogler | Stability of BaSiH8, a hydride superconductor with a Tc above 70 K
|
| 35 | Ravi Kaushik | Finite Magnetic Temperature Interactions from First Principles |
