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Technological innovation is intimately related to knowledge creation and recombination. In this work we introduce a combined statistical and network-based approach to study collaboration in scientific authorship. We apply it to characterize…
Lithium-ion batteries rely on particulate porous electrodes to realize high performance, especially the fast-charging capability. To minimize the particle-wise reaction heterogeneities that may lead to local hot spots, deeper understandings…
Lithium-ion batteries are playing a key role in the sustainable energy transition. To fully exploit the potential of this technology, a variety of modeling, estimation, and prediction problems need to be addressed to enhance its design and…
The sharing and citation of research data is becoming increasingly recognized as an essential building block in scientific research across various fields and disciplines. Sharing research data allows other researchers to reproduce results,…
Two key issues hindering the transition towards FAIR data science are the poor discoverability and inconsistent instructions for the use of data extractor tools, i.e., how we go from raw data files created by instruments, to accessible…
Higher loading of active electrode materials is desired in batteries, especially those based on conversion reactions, for enhanced energy density and cost efficiency. However, increasing active material loading in electrodes can cause…
Unpredictability of battery lifetime has been a key stumbling block to technology advancement of safety-critical systems such as electric vehicles and stationary energy storage systems. In this work, we present a novel hybrid fusion…
Atomistic modeling of solid-solid battery interfaces is essential for understanding electro-chemo-mechanical coupling, but the complex interfacial chemistry and heterogeneous environments pose major challenges for quantum-accurate,…
The time-consuming formation process critically impacts the longevity of sodium-ion coin cells and End Of Life (EOL) performance. This study aims to optimize formation protocols for duration efficiency, targeting high-performance outcomes…
Ubiquitous use of lithium-ion batteries across multiple industries presents an opportunity to explore cost saving initiatives as the price to performance ratio continually decreases in a competitive environment. Manufacturers using…
Efficient and reliable energy systems are key to progress of society. High performance batteries are essential for widely used technologies like Electric Vehicles (EVs) and portable electronics. Additionally, an effective Battery Management…
Density Functional Theory (DFT) calculations of electrode material properties in high energy density storage devices like lithium batteries have been standard practice for decades. In contrast, DFT modelling of explicit interfaces in…
The synthesis process is essential for achieving computational experiment design in the field of inorganic materials chemistry. In this work, we present a novel corpus of the synthesis process for all-solid-state batteries and an automated…
Effective communication is a critical factor in successful software engineering collaboration. However, communication gaps remain a persistent challenge, often leading to misunderstandings, inefficiencies, and defects. This research…
The design of correlated materials challenges researchers to combine the maturing, high throughput framework of DFT-based materials design with the rapidly-developing first-principles theory for correlated electron systems. We review the…
In the context of quantum thermodynamics, quantum batteries have emerged as promising devices for energy storage and manipulation. Over the past decade, substantial progress has been made in understanding the fundamental properties of…
High power operation in extreme fast charging significantly increases the risk of internal faults in Electric Vehicle batteries which can lead to accelerated battery failure. Early detection of these faults is crucial for battery safety and…
Lithium ion batteries have been a central part of consumer electronics for decades. More recently, they have also become critical components in the quickly arising technological fields of electric mobility and intermittent renewable energy…
Accurate forecasting of lithium-ion battery capacity degradation is critical for reliable and safe operation, yet remains challenging under distribution shifts across scales and operating regimes. Here we investigate a time-series…
The use of transition group metals in electric batteries requires extensive usage of critical elements like lithium, cobalt and nickel, which poses significant environmental challenges. Replacing these metals with redox-active organic…