Author pages are created from data sourced from our academic publisher partnerships and public sources.

Publications Influence

Share This Author

Maximally localized generalized Wannier functions for composite energy bands

- N. Marzari, D. Vanderbilt
- Physics
- 14 July 1997

We discuss a method for determining the optimally localized set of generalized Wannier functions associated with a set of Bloch bands in a crystalline solid. By ''generalized Wannier functions'' we… Expand

Maximally-localized Wannier Functions: Theory and Applications

- N. Marzari, A. Mostofi, J. Yates, I. Souza, D. Vanderbilt
- Physics
- 22 December 2011

The electronic ground state of a periodic system is usually described in terms of extended Bloch orbitals, but an alternative representation in terms of localized "Wannier functions" was introduced… Expand

wannier90: A tool for obtaining maximally-localised Wannier functions

- A. Mostofi, J. Yates, Young-Su Lee, I. Souza, D. Vanderbilt, N. Marzari
- Physics, Computer ScienceComput. Phys. Commun.
- 4 August 2007

TLDR

Maximally localized Wannier functions for entangled energy bands

- I. Souza, N. Marzari, D. Vanderbilt
- Physics
- 1 March 2001

We present a method for obtaining well-localized Wannier-like functions (WF's) for energy bands that are attached to or mixed with other bands. The present scheme removes the limitation of the usual… Expand

An updated version of wannier90: A tool for obtaining maximally-localised Wannier functions

- A. Mostofi, J. Yates, +4 authors N. Marzari
- Physics, Computer ScienceComput. Phys. Commun.
- 1 August 2014

TLDR

Magnetoelectric polarizability and axion electrodynamics in crystalline insulators.

- A. Essin, Joel E Moore, D. Vanderbilt
- Physics, MedicinePhysical review letters
- 16 October 2008

TLDR

Wannier representation of Z 2 topological insulators

- A. Soluyanov, D. Vanderbilt
- Physics
- 16 March 2010

We consider the problem of constructing Wannier functions for ${\mathbb{Z}}_{2}$ topological insulators in two dimensions. It is well known that there is a topological obstruction to the construction… Expand

Computing topological invariants without inversion symmetry

- A. Soluyanov, D. Vanderbilt
- Physics
- 28 February 2011

We consider the problem of calculating the weak and strong topological indices in noncentrosymmetric time-reversal ($\mathcal{T}$) invariant insulators. In 2D we use a gauge corresponding to hybrid… Expand

Wannier90 as a community code: new features and applications.

- G. Pizzi, V. Vitale, +28 authors J. Yates
- Medicine, PhysicsJournal of physics. Condensed matter : an…
- 23 July 2019

TLDR

Spectral and Fermi surface properties from Wannier interpolation

- J. Yates, XinJie Wang, D. Vanderbilt, I. Souza
- Physics
- 23 February 2007

We present an efficient first-principles approach for calculating Fermi surface averages and spectral properties of solids, and use it to compute the low-field Hall coefficient of several cubic… Expand

...

1

2

3

4

5

...