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Evaluating multi-center molecular integrals with Cartesian Gaussian-type basis sets has been a long-standing bottleneck in electronic structure theory calculation for solids and molecules. We have developed a vector-coupling and…

Quantum Physics · Physics 2024-05-17 Hang Hu , Gilles Peslherbe , Hsu Kiang Ooi , Anguang Hu

Simulating the evolution of the local universe is important for studying galaxies and the intergalactic medium in a way free of cosmic variance. Here we present a method to reconstruct the initial linear density field from an input…

Cosmology and Nongalactic Astrophysics · Physics 2015-06-22 Huiyuan Wang , H. J. Mo , Xiaohu Yang , Y. P. Jing , W. P. Lin

In pursuing the essential elements of nuclear binding, we compute ground-state properties of atomic nuclei with up to $A=20$ nucleons, using as input a leading order pionless effective field theory Hamiltonian. A variational Monte Carlo…

Nuclear Theory · Physics 2023-09-01 A. Gnech , B. Fore , A. Lovato

In this paper we consider the effects of resonance and electron scattering on the escape of Lyman alpha photons during cosmological hydrogen recombination. We pay particular attention to the influence of atomic recoil, Doppler boosting and…

Cosmology and Nongalactic Astrophysics · Physics 2015-05-13 J. Chluba , R. A. Sunyaev

Induced emission due to the presence of soft CMB photons slightly increases the two-photon decay rate of the 2s level of hydrogen defining the rate of cosmological recombination. This correspondingly changes the degree of ionization, the…

Astrophysics · Physics 2009-11-13 J. Chluba , R. A. Sunyaev

Numerical methods for radiative transfer play a key role in modern-day astrophysics and cosmology, including study of the inhomogeneous reionization process. In this context, ray tracing methods are well-regarded for accuracy but notorious…

Instrumentation and Methods for Astrophysics · Physics 2025-12-16 Nathan X. Marshak , Kathlynn Simotas , Zarija Lukić , Hyunbae Park , James Ahrens , Chris R. Johnson

In this paper we compute the emission coming from the direct recombination of free electrons to a given shell (n>=2) during the epoch of cosmological hydrogen recombination. This contribution leads to a total of one photon per recombined…

Astrophysics · Physics 2009-11-11 J. Chluba , R. A. Sunyaev

Active qubit reset is a key operation in many quantum algorithms, and particularly in error correction codes. Here, we experimentally demonstrate a reset scheme of a three level transmon artificial atom coupled to a large bandwidth…

The preparation of the ground state of a Hamiltonian $H$ with a large spectral radius has applications in many areas such as electronic structure theory and quantum field theory. Given an initial state with a constant overlap with the…

Quantum Physics · Physics 2024-06-05 Yulong Dong , Lin Lin

A cosmological multidimensional hydrodynamic code is described and tested. This code is based on modern high-resolution shock-capturing techniques. It can make use of a linear or a parabolic cell reconstruction as well as an approximate…

Astrophysics · Physics 2016-08-15 Vicent Quilis , Jose Ma. Ibanez , Diego Saez

The physical ingredients to describe the epoch of cosmological recombination are amazingly simple and well-understood. This fact allows us to take into account a very large variety of physical processes, still finding potentially measurable…

Cosmology and Nongalactic Astrophysics · Physics 2015-05-13 R. A. Sunyaev , J. Chluba

We present a refined treatment of H, He I, and He II recombination in the early Universe. The difference from previous calculations is that we use multi-level atoms and evolve the population of each level with redshift by including all…

Astrophysics · Physics 2009-10-31 Sara Seager , Dimitar D. Sasselov , Douglas Scott

Large-scale cosmological simulations of galaxy formation currently do not resolve the densities at which molecular hydrogen forms, implying that the atomic-to-molecular transition must be modeled either on the fly or in postprocessing. We…

Simulating charged many-body systems has been a computational demanding task due to the long-range nature of electrostatic interaction. For the multi-scale model of electrolytes which combines the strengths of atomistic/continuum…

Computational Physics · Physics 2022-07-22 Jing Fu , Zecheng Gan

We study the formation of first molecules, negative Hydrogen ions and molecular ions in model of the Universe with cosmological constant and cold dark matter. The cosmological recombination is described in the framework of modified model of…

Cosmology and Nongalactic Astrophysics · Physics 2018-02-14 B. Novosyadlyj , O. Sergijenko , V. M. Shulga

A classical approach based on hyperspherical coordinates is used to derive a first principle formulation of the the ion-neutral-neutral three-body recombination rate, A$^+$ + A + A $\rightarrow$ $\text{A}_2^+$ + A, in terms of the mass of…

Atomic Physics · Physics 2018-12-19 Jesús Pérez-Ríos , Chris H. Greene

We survey the results of a long-term study of the process of radiative recombination. A rigorous theory of nonrelativistic electron radiative recombination with a hydrogen-like ion is used to calculate the total cross section of the…

Atomic Physics · Physics 2019-03-27 Igor A. Kotelnikov , Alexander I. Milstein

The process of recombination for the hydrogen atom in the heat bath creating the blackbody radiation is descibed within the frameworks of quantum electrodynamics. For this purpose the self-energy for unbound electron in the field of the…

Atomic Physics · Physics 2019-07-17 D. Solovyev , T. Zalialiutdinov , A. Anikin , J. Triaskin , L. Labzowsky

In this era of precision cosmology, a detailed physical understanding on the evolution of cosmic baryons is required. Cosmic magnetic fields, though still poorly understood, may represent an important component in the global cosmic energy…

Astrophysics · Physics 2015-06-24 Shengtai Li , Hui Li , Renyue Cen

Radiation from stars and AGN plays an important role in galaxy formation and evolution, and profoundly transforms the IGM, CGM & ISM. On-the-fly RT has started being incorporated in cosmological simulations, but the complex, evolving…

Astrophysics of Galaxies · Physics 2024-11-20 Bernhard Baumschlager , Sijing Shen , James W. Wadsley