Substitutional tin acceptor states in black phosphorus

Mark Wentink , Julian Gaberle , Martik Aghajanian , Arash A Mostofi
The Journal of Physical Chemistry C 125 ( 41) 22883 -22889

3
2021
Atomistic Hartree theory of twisted double bilayer graphene near the magic angle

Christopher TS Cheung , Zachary AH Goodwin , Valerio Vitale , Johannes Lischner
Electronic Structure 4 ( 2) 025001

2
2022
OPTIMADE, an API for exchanging materials data

Casper W Andersen , Rickard Armiento , Evgeny Blokhin , Gareth J Conduit
Scientific Data 8 217 -217

84
2021
Linear-scaling DFT+ U with full local orbital optimization

David D O'Regan , Nicholas DM Hine , Mike C Payne , Arash A Mostofi
Physical Review B 85 085107 -085107

39
2011
Flat band properties of twisted transition metal dichalcogenide homo- and heterobilayers of MoS2, MoSe2, WS2 and WSe2

Valerio Vitale , Kemal Atalar , Arash A Mostofi , Johannes Lischner
2D Materials 8 ( 4) 045010 -045010

56
2021
Unconventional superconductivity in magic-angle twisted trilayer graphene

Ammon Fischer , Zachary AH Goodwin , Arash A Mostofi , Johannes Lischner
npj Quantum Materials 7 ( 1) 5 -5

41
2022
Molecular Simulation of Gas Solubility in Nitrile Butadiene Rubber

Musab Khawaja , Adrian P Sutton , Arash A Mostofi
The Journal of Physical Chemistry B 121 ( 1) 287 -297

25
2016
RETRACTED ARTICLE: ONETEP: linear-scaling density-functional theory with plane-waves

Arash A Mostofi , Peter D Haynes , C-K Skylaris , Mike C Payne
Molecular Simulation 33 ( 7) 551 -555

21
2007
Electrically induced dirac fermions in graphene nanoribbons

Michele Pizzochero , Nikita V Tepliakov , Arash A Mostofi , Efthimios Kaxiras
Nano Letters 21 ( 21) 9332 -9338

14
2021
Chiral valley phonons and flat phonon bands in moiré materials

Indrajit Maity , Arash A Mostofi , Johannes Lischner
Physical Review B 105 ( 4) L041408 -L041408

13
2022
Negative-U properties for substitutional Au in Si

Fabiano Corsetti , Arash A Mostofi
Europhysics Letters 105 ( 5) 57006 -57006

10
2014
A first-principles study of As doping at a disordered Si–SiO2 interface

Fabiano Corsetti , Arash A Mostofi
Journal of Physics: Condensed Matter 26 ( 5) 055002 -055002

5
2013
Effect of Coulomb impurities on the electronic structure of magic angle twisted bilayer graphene

Muhammad Sufyan Ramzan , Zachary AH Goodwin , Arash A Mostofi , Agnieszka Kuc
npj 2D Materials and Applications 7 ( 1) 49 -49

4
2023
Combining embedded mean-field theory with linear-scaling density-functional theory

Joseph CA Prentice , Robert J Charlton , Arash A Mostofi , Peter D Haynes
Journal of Chemical Theory and Computation 16 354 -354

3
2019
Short Versus Long Range Exchange Interactions in Twisted Bilayer Graphene

Alejandro Jimeno‐Pozo , Zachary AH Goodwin , Pierre A Pantaleón , Valerio Vitale
Advanced Physics Research 2 ( 12) 2300048 -2300048

2
2023
The effect of chemistry and thermal fluctuations on charge injection barriers at aluminum/polyolefin interfaces

Yiyuan Wang , Sari J Laihonen , Mikael Unge , Arash A Mostofi
Journal of Applied Physics 134 ( 12)

2
2023
A corkscrew model for highly coupled anisotropic compliance in Ruddlesden-Popper oxides with frozen octahedral rotations

Chris Ablitt , Mark S Senn , Nicholas C Bristowe , Arash A Mostofi
arXiv preprint arXiv:1810.02697

2
2018
Electrons surf phason waves in moiré bilayers

Indrajit Maity , Arash A Mostofi , Johannes Lischner
Nano Letters 23 ( 11) 4870 -4875

1
2023
Optical Properties of Charged Defects in Monolayer MoS2

Martik Aghajanian , Arash A Mostofi , Johannes Lischner
Electronic Structure 5 045012 -045012

2023
Minimal parameter implicit solvent model for ab initio electronic-structure calculations

C.-K. Skylaris , J. Dziedzic , A. A. Mostofi , M. C. Payne
EPL 95 ( 4) 43001

106
2011