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Both hydrogen and natural gas are challenging to economically store onboard vehicles as fuels, due to their low volumetric energy density at ambient conditions. One strategy to densify these gases is to pack the fuel tank with a porous…

Chemical Physics · Physics 2021-10-14 Jordan K. Pommerenck , Cory M. Simon , David Roundy

Hydrogen, an essential resource in the decarbonized economy, is commonly produced as a by-product of chemical plants. To promote the use of by-product hydrogen, this paper proposes a supply chain model among chemical plants,…

Systems and Control · Electrical Eng. & Systems 2022-11-08 Qianni Cao , Boda Li , Mengshuo Jia , Chen Shen

Hydrogen technology is set to be a key energy alternative for mitigating pollution and reducing CO$_2$ emissions. However, the current storage mechanism of hydrogen molecules in carbon fibre tanks detracts from the fuel economy of hydrogen…

Materials Science · Physics 2026-04-09 Yasmine S. Al-Hamdani , Dario Alfè , Andrea Zen

We introduce an efficient scheme for the molecular dynamics of electronic systems by means of quantum Monte Carlo. The evaluation of the (Born-Oppenheimer) forces acting on the ionic positions is achieved by two main ingredients: i) the…

Strongly Correlated Electrons · Physics 2009-11-13 Claudio Attaccalite , Sandro Sorella

Power-to-Hydrogen is crucial for the renewable energy transition, yet existing literature lacks business models for the significant excess heat it generates. This study addresses this by evaluating three models for selling…

Multiagent Systems · Computer Science 2024-08-21 Kristoffer Christensen , Bo Nørregaard Jørgensen , Zheng Grace Ma

Large scale production of hydrogen by electrochemical water splitting is considered as a promising technology to address critical energy challenges caused by the extensive use of fossil fuels. Although nonprecious nickel-based catalysts…

Chemical Physics · Physics 2021-08-31 Yuting Luo , Zhiyuan Zhang , Fengning Yang , Jiong Li , Zhibo Liu , Wencai Ren , Shuo Zhang , Bilu Liu

According to the International Energy Agency, each human uses more than 80 GJ of energy per year; this is equivalent to leaving a washing machine continuously running for one year for every person on Earth. This consumption is expected to…

Quantum Physics · Physics 2023-10-23 James Q. Quach , Giulio Cerullo , Tersilla Virgili

Accurate monitoring of the hydrogen concentration is critical for optimizing fuel cell performance, minimizing purge losses, and reducing long-term degradation. Conventional hydrogen sensors often rely on catalytic materials and face…

Hydrogen is a key player in global strategies to reduce greenhouse gas emissions. In order to make hydrogen a widely-used fuel, we require more efficient methods of storing it than the current standard of pressurized cylinders. An…

Materials Science · Physics 2025-01-14 Yasmine S. Al-Hamdani , Andrea Zen , Angelos Michaelides , Dario Alfè

The search for suitable materials for solid-state stationary storage of green hydrogen is pushing the implementation of efficient renewable energy systems. This involves rational design and modification of cheap alloys for effective storage…

Materials Science · Physics 2021-04-23 Erika Michela Dematteis , Nicola Berti , Fermin Cuevas , Michel Latroche , Marcello Baricco

Ab initio density-functional theory study suggests that pillared Li-dispersed boron carbide nanotubes is capable of storing hydrogen with a mass density higher than 6.0 weight% and a volumetric density higher than 45 g/L. The boron…

Materials Science · Physics 2007-05-23 Xiaojun Wu , Yi Gao , Xiao Cheng Zeng

Graphene oxide is a rising star among 2D materials, yet its interaction with liquid water remains a fundamentally open question: experimental characterization at the atomic scale is difficult, and modelling by classical approaches cannot…

Materials Science · Physics 2020-03-27 Félix Mouhat , François-Xavier Coudert , Marie-Laure Bocquet

The use of renewable energy sources is a major strategy to mitigate climate change. Yet Sinn (2017) argues that excessive electrical storage requirements limit the further expansion of variable wind and solar energy. We question, and alter,…

Physics and Society · Physics 2018-07-19 Alexander Zerrahn , Wolf-Peter Schill , Claudia Kemfert

We found good reversibility of hydrogen uptake-release in vacancy-centered hexagonal armchair nanographene (VANG) based on density functional theory calculation. VANG has a triply hydrogenated vacancy (V$_{111}$) at the center and acts as a…

Materials Science · Physics 2022-07-01 Gagus Ketut Sunnardianto , Yusuf Wicaksono , Halimah Harfah , Koichi Kusakabe

The application of the flow tracing method to power flows in and out of storage units allows to analyse the usage of this technology option in large-scale interconnected electricity systems. We apply this method to a data-driven model of…

Physics and Society · Physics 2018-10-26 Bo Tranberg , Mirko Schäfer , Tom Brown , Jonas Hörsch , Martin Greiner

Adsorption is one important way applied to water decontamination, where carbon is commonly used as highly effective absorbent. Carbon of different morphologies and structures normally demonstrate distinct capabilities to adsorption-typed…

Materials Science · Physics 2017-05-02 Sun Ling

A proposal to store unsteady energy in potential energy via lifting masses with a rough quantitative overview. Some applications and methods to harvest the potential energy are also given. A focus is put on photovoltaically generated…

General Physics · Physics 2012-02-14 Nadja Kutz

Deep decarbonization of the electricity sector can be provided by a high penetration of renewable sources such as wind, solar PV and hydro power. Flexibility from hydro and storage complements the high temporal variability of wind and…

Physics and Society · Physics 2019-02-18 Hailiang Liu , Tom Brown , Gorm Bruun Andresen , David P. Schlachtberger , Martin Greiner

Hydrogen, while a promising sustainable energy carrier, presents challenges such as the embrittlement of materials due to its ability to penetrate and weaken their crystal structures. Here we investigate Fe4N nitride layers, formed on iron…

Hydration properties of graphene oxide (GO) are essential for most of its potential applications. In this work, we employ atomistic molecular dynamics simulations to investigate seven GO compositions with different levels of oxygenation.…

Materials Science · Physics 2018-02-14 Antenor Neto , Vitaly V. Chaban , Eudes E. Fileti