T. Rangel

activity

20112020

most citedLarge bulk photovoltaic effect and spontaneous polarization of single-layer monochalcogenides

295 citations · 1.1k across the 16 of their papers we have counts for

collaborators

Showing 2019Show all

2 papers · 1 filter

cond-mat.mtrl-sci2019★ 62 cited

Reproducibility in $G_{0} W_{0}$ Calculations for Solids

Tonatiuh Rangel, Mauro Del Ben, Daniele Varsano +13

Ab initio many-body perturbation theory within the $G W$ approximation is a Green's function formalism widely used in the calculation of quasiparticle excitation energies of solids.…

cond-mat.mtrl-sci2019★ 66 cited

Towards predictive band gaps for halide perovskites: Lessons from one-shot and eigenvalue self-consistent GW

Linn Leppert, Tonatiuh Rangel, Jeffrey B. Neaton

Halide perovskites constitute a chemically-diverse class of crystals with great promise as photovoltaic absorber materials, featuring band gaps between about 1 and 3.5 eV depending…

Reproducibility in G0​W0​ Calculations for Solids

Towards predictive band gaps for halide perovskites: Lessons from one-shot and eigenvalue self-consistent GW

Reproducibility in $G_{0} W_{0}$ Calculations for Solids