Orbital-free density functional theory: An attractive electronic structure method for large-scale first-principles simulations

W Mi, K Luo, SB Trickey, M Pavanello - Chemical Reviews, 2023 - ACS Publications
Kohn–Sham Density Functional Theory (KSDFT) is the most widely used electronic structure
method in chemistry, physics, and materials science, with thousands of calculations cited …

Dense nuclear matter equation of state from heavy-ion collisions

A Sorensen, K Agarwal, KW Brown, Z Chajęcki… - Progress in Particle and …, 2024 - Elsevier
The nuclear equation of state (EOS) is at the center of numerous theoretical and
experimental efforts in nuclear physics. With advances in microscopic theories for nuclear …

The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry

G Li Manni, I Fdez. Galván, A Alavi… - Journal of chemical …, 2023 - ACS Publications
The developments of the open-source OpenMolcas chemistry software environment since
spring 2020 are described, with a focus on novel functionalities accessible in the stable …

Quantum decoherence

M Schlosshauer - Physics Reports, 2019 - Elsevier
Quantum decoherence plays a pivotal role in the dynamical description of the quantum-to-
classical transition and is the main impediment to the realization of devices for quantum …

Ab initio nonadiabatic quantum molecular dynamics

BFE Curchod, TJ Martínez - Chemical reviews, 2018 - ACS Publications
The Born–Oppenheimer approximation underlies much of chemical simulation and provides
the framework defining the potential energy surfaces that are used for much of our pictorial …

Wigner formulation of thermal transport in solids

M Simoncelli, N Marzari, F Mauri - Physical Review X, 2022 - APS
Two different heat-transport mechanisms are discussed in solids. In crystals, heat carriers
propagate and scatter particlelike as described by Peierls's formulation of the Boltzmann …

From quantum chaos and eigenstate thermalization to statistical mechanics and thermodynamics

L D'Alessio, Y Kafri, A Polkovnikov, M Rigol - Advances in Physics, 2016 - Taylor & Francis
This review gives a pedagogical introduction to the eigenstate thermalization hypothesis
(ETH), its basis, and its implications to statistical mechanics and thermodynamics. In the first …

Non-Gaussian quantum states and where to find them

M Walschaers - PRX quantum, 2021 - APS
Gaussian states have played an important role in the physics of continuous-variable
quantum systems. They are appealing for the experimental ease with which they can be …

Photonic spin-controlled multifunctional shared-aperture antenna array

E Maguid, I Yulevich, D Veksler, V Kleiner… - Science, 2016 - science.org
The shared-aperture phased antenna array developed in the field of radar applications is a
promising approach for increased functionality in photonics. The alliance between the …

Electron-Ion Collider: The next QCD frontier: Understanding the glue that binds us all

A Accardi, JL Albacete, M Anselmino… - The European Physical …, 2016 - Springer
This White Paper presents the science case of an Electron-Ion Collider (EIC), focused on the
structure and interactions of gluon-dominated matter, with the intent to articulate it to the …