QUANTUM ESPRESSO is an integrated suite of computer codes for electronic-structure calculations and materials modeling, based on density-functional theory, plane waves, and pseudopotentials (norm-conserving, ultrasoft, and projector-augmented wave). The acronym ESPRESSO stands for opEn Source Package for Research in Electronic Structure, Simulation, and Optimization. It is freely available to researchers around the world under the…
Journal of Physics: Condensed Matter Template
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About the Journal of Physics: Condensed Matter format
Journal of Physics: Condensed Matter is a peer-reviewed journal published by IOP Publishing, covering Physics of Superconductivity and Magnetism, Quantum and electron transport phenomena, Advanced Condensed Matter Physics. Over its lifetime it has published 40,997 papers, which have received 1,027,870 citations.
| Publisher | IOP Publishing |
|---|---|
| Reference style | Numbered (IOP) Numbered — [1], [2] in the text [1] Smith A, Jones B and Lee C 2023 A representative article title Journal of Physics: Condensed Matter 12 45–58
Formats any DOI in Journal of Physics: Condensed Matter style. No sign-up. |
| Publishes research in | Physics of Superconductivity and Magnetism Quantum and electron transport phenomena Advanced Condensed Matter Physics Magnetic and transport properties of perovskites and related materials Rare-earth and actinide compounds |
| ISSN | 0953-8984 |
| Citation impact (2-yr) | 2.23 |
| h-index | 284 |
| i10-index | 20,684 |
| Top institutions publishing here | Centre National de la Recherche Scientifique |
| Journal website | iopscience.org |
| You get | A submission-ready PDF and the editable LaTeX source — ready to submit. |
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Most-cited papers in Journal of Physics: Condensed Matter
35 pages, 8 figures.-- Printed version published on Mar 25, 2002.-- ArXiv pre-print available at: http://arxiv.org/abs/cond-mat/0111138
First-principles simulation, meaning density-functional theory calculations with plane waves and pseudopotentials, has become a prized technique in condensed-matter theory. Here I look at the basics of the suject, give a brief review of the theory, examining the strengths and weaknesses of its implementation, and illustrating some of the ways simulators approach problems through a small…
Quantum EXPRESSO is an integrated suite of open-source computer codes for quantum simulations of materials using state-of-the-art electronic-structure techniques, based on density-functional theory, density-functional perturbation theory, and many-body perturbation theory, within the plane-wave pseudopotential and projector-augmented-wave approaches. Quantum EXPRESSO owes its popularity to the wide variety of properties and processes it allows to simulate, to…
A computational method for partitioning a charge density grid into Bader volumes is presented which is efficient, robust, and scales linearly with the number of grid points. The partitioning algorithm follows the steepest ascent paths along the charge density gradient from grid point to grid point until a charge density maximum is reached. In this…