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most citedAtomistic origins of high-performance in hybrid halide perovskite solar cells

2.4k citations · 4.9k across the 35 of their papers we have counts for

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cond-mat.str-el2022★ 27 cited

A Theory for Colors of Strongly Correlated Electronic Systems

Swagata Acharya, Cedric Weber, Dimitar Pashov +3

Many strongly correlated transition metal insulators are colored, even though they have large fundamental band gaps and no quasi-particle excitations in the visible range. Why such…

cond-mat.str-el2021★ 36 cited

First principles vs second principles: Role of charge self-consistency in strongly correlated systems

Swagata Acharya, Dimitar Pashov, Alexander N. Rudenko +3

First principles approaches have been successful in solving many-body Hamiltonians for real materials to an extent when correlations are weak or moderate. As the electronic correla…

cond-mat.str-el2020★ 2 cited

Disentangling the role of bond lengths and orbital symmetries in controlling in YBaCuO

Francois Jamet, Cedric Weber, Swagata Acharya +2

Optimally doped YBCO (YBaCuO) has a high critical temperature, at 92 K. It is largely believed that Cooper pairs form in YBCO and other cuprates because of spin f…

cond-mat.str-el2020★ 12 cited

Role of nematicity in controlling spin fluctuations and superconducting Tc in bulk FeSe

Swagata Acharya, Dimitar Pashov, Mark van Schilfgaarde

FeSe undergoes a transition from a tetragonal to a slightly orthorhombic phase at 90\,K, and becomes a superconductor below 8\,K. The orthorhombic phase is sometimes called a nemat…

cond-mat.str-el2017★ 13 cited

Metal-insulator transition in copper oxides induced by apex displacements

Swagata Acharya, Cedric Weber, Evgeny Plekhanov +3

High temperature superconductivity has been found in many kinds of compounds built from planes of Cu and O, separated by spacer layers. Understanding why critical temperatures are…

cond-mat.str-el2016★ 58 cited

Self-energies in itinerant magnets: A focus on Fe and Ni

L. Sponza, P. Pisanti, A. Vishina +6

We present a detailed study of local and non-local correlations in the electronic structure of elemental transition metals carried out by means of the Quasiparticle Self-consistent…

cond-mat.str-el2016★ 28 cited

High photon energy spectroscopy of NiO: experiment and theory

S. K. Panda, Banabir Pal, Suman Mandal +12

We have revisited the valence band electronic structure of NiO by means of hard x-ray photoemission spectroscopy (HAXPES) together with theoretical calculations using both the GW m…

cond-mat.str-el2015

First-principles treatment of Mott insulators: linearized QSGW+DMFT approach

Sangkook Choi, Andrey Kutepov, Kristjan Haule +2

The theoretical understanding of emergent phenomena in quantum materials is one of the greatest challenges in condensed matter physics. In contrast to simple materials such as nobl…

cond-mat.str-el2012★ 8 cited

The Electronic Correlation Strength of Pu

A. Svane, R. C. Albers, N. E. Christensen +3

An electronic quantity, the correlation strength, is defined as a necessary step for understanding the properties and trends in strongly correlated electronic materials. As a test…