644 citations · 3k across the 76 of their papers we have counts for
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Computationally-driven, high throughput identification of CaTe and LiSb as promising candidates for high mobility -type transparent conducting materials
Viet-Anh Ha, Guodong Yu, Francesco Ricci +5
High-performance -type transparent conducting materials (TCMs) must exhibit a rare combination of properties including high mobility, transparency and -type dopability. The d…
Are Small Polarons Always Detrimental to Transparent Conducting Oxides ?
Guillaume Brunin, Gian-Marco Rignanese, Geoffroy Hautier
Transparent conducting oxides (TCOs) are essential to many technologies including solar cells and transparent electronics. The search for high performance n- or p-type TCOs has mai…
Searching for Materials with High Refractive Index and Wide Band Gap: A First-Principles High-Throughput Study
Francesco Naccarato, Francesco Ricci, Jin Suntivich +3
Materials combining both a high refractive index and a wide band gap are of great interest for optoelectronic and sensor applications. However, these two properties are typically d…
An unlikely route to low lattice thermal conductivity: small atoms in a simple layered structure
Wanyue Peng, Guido Petretto, Gian-Marco Rignanese +2
In the design of materials with low lattice thermal conductivity, compounds with high density, low speed of sound, and complexity at either the atomic, nano- or microstructural lev…
High-Throughput Identification of Electrides from all Known Inorganic Materials
Lee A. Burton, Francesco Ricci, Gian-Marco Rignanese +1
In this paper, we present the results of a large-scale, high-throughput computational search for electrides among all known inorganic materials. Analyzing a database of density fun…