Materials for solar fuels and chemicals
The conversion of sunlight into fuels and chemicals is an attractive prospect for the storage
of renewable energy, and photoelectrocatalytic technologies represent a pathway by which …
of renewable energy, and photoelectrocatalytic technologies represent a pathway by which …
Semiconducting materials for photoelectrochemical energy conversion
To achieve a sustainable society with an energy mix primarily based on solar energy, we
need methods of storing energy from sunlight as chemical fuels. Photoelectrochemical …
need methods of storing energy from sunlight as chemical fuels. Photoelectrochemical …
[HTML][HTML] WIEN2k: An APW+ lo program for calculating the properties of solids
The WIEN2k program is based on the augmented plane wave plus local orbitals (APW+ lo)
method to solve the Kohn–Sham equations of density functional theory. The APW+ lo …
method to solve the Kohn–Sham equations of density functional theory. The APW+ lo …
Crystal graph convolutional neural networks for an accurate and interpretable prediction of material properties
The use of machine learning methods for accelerating the design of crystalline materials
usually requires manually constructed feature vectors or complex transformation of atom …
usually requires manually constructed feature vectors or complex transformation of atom …
[HTML][HTML] Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
Accelerating the discovery of advanced materials is essential for human welfare and
sustainable, clean energy. In this paper, we introduce the Materials Project (www …
sustainable, clean energy. In this paper, we introduce the Materials Project (www …
Intrinsic thermal instability of methylammonium lead trihalide perovskite
B Conings, J Drijkoningen, N Gauquelin… - Advanced Energy …, 2015 - Wiley Online Library
Organolead halide perovskites currently are the new front‐runners as light absorbers in
hybrid solar cells, as they combine efficiencies passing already 20% with deposition …
hybrid solar cells, as they combine efficiencies passing already 20% with deposition …
Perovskites: the emergence of a new era for low-cost, high-efficiency solar cells
HJ Snaith - The journal of physical chemistry letters, 2013 - ACS Publications
Over the last 12 months, we have witnessed an unexpected breakthrough and rapid
evolution in the field of emerging photovoltaics, with the realization of highly efficient solid …
evolution in the field of emerging photovoltaics, with the realization of highly efficient solid …
Atomistic origins of high-performance in hybrid halide perovskite solar cells
The performance of organometallic perovskite solar cells has rapidly surpassed that of both
conventional dye-sensitized and organic photovoltaics. High-power conversion efficiency …
conventional dye-sensitized and organic photovoltaics. High-power conversion efficiency …
Data‐driven materials science: status, challenges, and perspectives
Data‐driven science is heralded as a new paradigm in materials science. In this field, data is
the new resource, and knowledge is extracted from materials datasets that are too big or …
the new resource, and knowledge is extracted from materials datasets that are too big or …
The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals
We introduce the Computational 2D Materials Database (C2DB), which organises a variety
of structural, thermodynamic, elastic, electronic, magnetic, and optical properties of around …
of structural, thermodynamic, elastic, electronic, magnetic, and optical properties of around …