Mesoscale and Nanoscale Physics · Physics
First-Principles Electron Transport with Phonon Coupling: Large-Scale at Low Cost
Tue Gunst, Troels Markussen, Mattias L. N. Palsgaard, Kurt Stokbro +1
2017-10-25
Superconductivity · Physics
First-principles-based $\pm s$-wave modelling for iron-based superconductors:Studies for specific heat and nuclear magnetic relaxation rate
N. Nakai, H. Nakamura, Y. Ota, Y. Nagai +2
2015-05-14
Materials Science · Physics
Polarons from first principles, without supercells
Weng Hong Sio, Carla Verdi, Samuel Ponce, Feliciano Giustino
2019-06-21
Superconductivity · Physics
Computationally efficient method for calculating electron-phonon coupling for high-throughput superconductivity search
Oliver A. Dicks, Kateryna Foyevtsova, Ilya Elfimov, Rohit Prasankumar +1
2024-05-07
Materials Science · Physics
Convergence and pitfalls of density functional perturbation theory phonons calculations from a high-throughput perspective
Guido Petretto, Xavier Gonze, Geoffroy Hautier, Gian-Marco Rignanese
2018-01-04
Materials Science · Physics
Ab initio theory of polarons: formalism and applications
Weng Hong Sio, Carla Verdi, Samuel Ponce, Feliciano Giustino
2019-06-21
Materials Science · Physics
Comparison between first-principles supercell calculations of polarons and the ab initio polaron equations
Zhenbang Dai, Donghwan Kim, Jon Lafuente-Bartolome, Feliciano Giustino
2026-03-25
Materials Science · Physics
First-principles theory of nonlinear long-range electron-phonon interaction
Matthew Houtput, Luigi Ranalli, Carla Verdi, Serghei Klimin +3
2025-05-20
Strongly Correlated Electrons · Physics
Accurate Electron-phonon Interactions from Advanced Density Functional Theory
Yanyong Wang, Manuel Engel, Christopher Lane, Henrique Miranda +8
2026-01-15
Materials Science · Physics
First-principles theory of nonlinear long-range electron-phonon interaction
Matthew Houtput, Luigi Ranalli, Carla Verdi, Serghei Klimin +3
2025-04-15
Superconductivity · Physics
Weak phonon-mediated pairing in BiS$_2$ superconductor from first principles
Corentin Morice, Ryosuke Akashi, Takashi Koretsune, Siddharth S. Saxena +1
2017-05-24
Materials Science · Physics
Phonons and related properties of extended systems from density-functional perturbation theory
S. Baroni, S. de Gironcoli, A. Dal Corso, P. Giannozzi
2009-10-31
Materials Science · Physics
Efficient First-Principles Framework for Overdamped Phonon Dynamics and Anharmonic Electron-Phonon Coupling in Superionic Materials
Yuxuan Wang, Marios Zacharias, Xiao Zhang, Nick Pant +3
2025-07-10
Materials Science · Physics
Density-functional perturbation theory for one-dimensional systems: implementation and relevance for phonons and electron-phonon interactions
Norma Rivano, Nicola Marzari, Thibault Sohier
2023-10-09
Superconductivity · Physics
Screening Induced Crossover between Phonon- and Plasmon-Mediated Pairing in Layered Superconductors
Yann in 't Veld, Mikhail I. Katsnelson, Andrew J. Millis, Malte Rösner
2024-08-21
Materials Science · Physics
Nonequilibrium Photocarrier and Phonon Dynamics from First Principles: a Unified Treatment of Carrier-Carrier, Carrier-Phonon, and Phonon-Phonon Scattering
Stefano Mocatti, Giovanni Marini, Giulio Volpato, Pierluigi Cudazzo +1
2025-12-10
Materials Science · Physics
Electron-Phonon Coupling in Many-Body Perturbation Theory: Developments within the Quasiparticle Self-Consistent GW approximation and LMTO Formalism
Savio Laricchia, Casey Eichstaedt, Dimitar Pashov, Mark van Schilfgaarde
2025-03-17