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Temperature- and vacancy-concentration-dependence of heat transport in Li3ClO from multi-method numerical simulations

Paolo Pegolo, Stefano Baroni, Federico Grasselli • npj Computational Materials (2022)

Abstract Despite governing heat management in any realistic device, the microscopic mechanisms of heat transport in all-solid-state electrolytes are poorly known: existing calculations, all based on simplistic semi-empirical models, are unr...

DOAJ Open Access (DOAJ) DOI: 10.1038/s41524-021-00693-4

Not All Sub-Neptune Exoplanets Have Magma Oceans

Bodie Breza, Matthew C. Nixon, Eliza M.-R. Kempton • The Astrophysical Journal Letters (2025)

The evolution and structure of sub-Neptunes may be strongly influenced by interactions between the outer gaseous envelope of the planet and a surface magma ocean. However, given the wide variety of permissible interior structures of these p...

DOAJ Open Access (DOAJ) DOI: 10.3847/2041-8213/ae0c07

Mechanism for rapid growth of organic–inorganic halide perovskite crystals

Pabitra K. Nayak, David T. Moore, Bernard Wenger, Simantini Nayak et al. • Nature Communications (2016)

Single crystals of lead halide perovskites exhibit good optoelectronic properties. Here, the authors study and deduce the mechanism for crystallisation and show how controlling dissolution of colloids through varying the acidity and tempera...

DOAJ Open Access (DOAJ) DOI: 10.1038/ncomms13303

Compositional tuning of structural, photothermal and optical properties of La-based high-entropy perovskite oxides

Anurag Khandelwal, Piyush Anil Kumar Sharma, Simon Schweidler, Pirmin Tischler et al. • Materials & Design (2026)

In this study, 14 lanthanum-based high-entropy perovskite oxides (HEPOs) with equimolar mixtures of transition metals (Cr, Mn, Fe, Co, Ni, Cu, Zn) at the B-site were synthesized to investigate how multi-elemental interactions govern their s...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.matdes.2026.116517

Complex structural evolution in BaTiO3 single crystals caused by the coexistence of competing anharmonic potentials

Annette Bussmann-Holder, Iwona Lazar, Andrzej Soszyński, Krystian Roleder • Materials & Design (2026)

BaTiO3 (BTO) was the first ferroelectric perovskite oxide discovered in the 1940′th.. It was also the first ferroelectric compound without hydrogen bonds. Its wide applicability, together with its simple cubic structure, directly intensifie...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.matdes.2026.116642

IoT-enabled real-time outdoor monitoring of perovskite BIPV system under real climatic conditions

Shahzad Aman, Aimal Daud Khan, Fahad Sadaqat, Adnan Daud Khan et al. • Results in Engineering (2026)

This study presents a first-of-its-kind IoT-enabled outdoor investigation of perovskite Building-Integrated Photovoltaic (BIPV) subsystems under real environmental operating conditions at Peshawar, Pakistan. Two architecturally distinct per...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.rineng.2026.113915

Exploring Ru 4d oxide Ba2XRuO6 (X = Y, Lu, Sc) for spintronics: pressure-dependent first-principles study

Razia Abdul Majid Qureshi, Altaf Ur Rahman, Altaf Ur Rahman, Muhammad Sajjad et al. • Frontiers in Chemistry (2026)

Recent advances in the precise control of electromagnetic and transport properties, and the miniaturization of electronic devices, have introduced new prospects in the development of practical quantum computing. Double perovskites have gain...

DOAJ Open Access (DOAJ) DOI: 10.3389/fchem.2026.1814481

Color‐Filter‐Free Image Sensor Using CsPbBr3 Quantum‐Dot‐Based Tamm Plasmon Photodetector for Photonic Synapse Facial Recognition

Meng‐Cheng Yen, Yung‐Chi Yao, Chia‐Jung Lee, Shi‐Hui Huang et al. • Advanced Science (2025)

Abstract This study demonstrates that optical absorption of the CsPbBr3 quantum dots can be significantly enhanced through monolithic integration with the Tamm plasmon (TP) structure. This integration enables the resulting TP photodetector ...

DOAJ Open Access (DOAJ) DOI: 10.1002/advs.202503464

Advances of Commercial and Biological Materials for Electron Transport Layers in Biological Applications

Zhifu Yin, Zhifu Yin, Biao Lu, Yanbo Chen et al. • Frontiers in Bioengineering and Biotechnology (2022)

Electron transport layer (ETL), one of the important layers for high-performing perovskite solar cells (PSCs), also has great potential in bioengineering applications. It could be used for biological sensors, biological imaging, and biomedi...

DOAJ Open Access (DOAJ) DOI: 10.3389/fbioe.2022.900269

The first observation of Ni nanoparticle exsolution from YSZ and its application for dry reforming of methane

Sangwook Joo, Chaehyun Lim, Ohhun Kwon, Linjuan Zhang et al. • Materials Reports: Energy (2021)

Ni nanocatalysts produced through exsolution have shown strong resistance to particle sintering and carbon coking in a beneficial dry reforming of methane (DRM) reaction utilizing greenhouse gases such as CH4 and CO2. However, most of the e...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.matre.2021.100021

Fast Exploring Literature by Language Machine Learning for Perovskite Solar Cell Materials Design

Lei Zhang, Yiru Huang, Leiming Yan, Jinghao Ge et al. • Advanced Intelligent Systems (2024)

Making computers automatically extract latent scientific knowledge from literature is highly desired for future materials and chemical research in the artificial intelligence era. Herein, the natural language processing (NLP)‐based machine ...

DOAJ Open Access (DOAJ) DOI: 10.1002/aisy.202300678

The challenge of studying perovskite solar cells’ stability with machine learning

Paolo Graniero, Paolo Graniero, Mark Khenkin, Hans Köbler et al. • Frontiers in Energy Research (2023)

Perovskite solar cells are the most dynamic emerging photovoltaic technology and attracts the attention of thousands of researchers worldwide. Recently, many of them are targeting device stability issues–the key challenge for this technolog...

DOAJ Open Access (DOAJ) DOI: 10.3389/fenrg.2023.1118654