Emerging quantum computing algorithms for quantum chemistry

M Motta, JE Rice - Wiley Interdisciplinary Reviews …, 2022 - Wiley Online Library
Digital quantum computers provide a computational framework for solving the Schrödinger
equation for a variety of many‐particle systems. Quantum computing algorithms for the …

Evolution and mass loss of cool aging stars: a daedalean story

L Decin - Annual Review of Astronomy and Astrophysics, 2021 - annualreviews.org
A multitude of phenomena—such as the chemical enrichment of the Universe, the mass
spectrum of planetary nebulae, white dwarfs and gravitational wave progenitors, the …

2018 census of interstellar, circumstellar, extragalactic, protoplanetary disk, and exoplanetary molecules

BA McGuire - The Astrophysical Journal Supplement Series, 2018 - iopscience.iop.org
To date, 204 individual molecular species, comprised of 16 different elements, have been
detected in the interstellar and circumstellar medium by astronomical observations. These …

2021 census of interstellar, circumstellar, extragalactic, protoplanetary disk, and exoplanetary molecules

BA McGuire - The Astrophysical Journal Supplement Series, 2022 - iopscience.iop.org
To date, 241 individual molecular species, composed of 19 different elements, have been
detected in the interstellar and circumstellar medium by astronomical observations. These …

The magnesium paradigm in IRC+ 10216: discovery of MgC4H+, MgC3N+, MgC6H+, and MgC5N+

J Cernicharo, C Cabezas, JR Pardo… - Astronomy & …, 2023 - aanda.org
We found four series of harmonically related lines in IRC+ 10216 with the Yebes 40 m and
IRAM 30 m telescopes. The first series corresponds to a molecule with a rotational constant …

TMC-1, the starless core sulfur factory: Discovery of NCS, HCCS, H2CCS, H2CCCS, and C4S and detection of C5S

J Cernicharo, C Cabezas, M Agúndez… - Astronomy & …, 2021 - aanda.org
We report the detection of the sulfur-bearing species NCS, HCCS, H 2 CCS, H 2 CCCS, and
C 4 S for the first time in space. These molecules were found towards TMC-1 through the …

Chemical equilibrium in AGB atmospheres: successes, failures, and prospects for small molecules, clusters, and condensates

M Agúndez, JI Martínez, PL de Andres… - Astronomy & …, 2020 - aanda.org
Chemical equilibrium has proven extremely useful for predicting the chemical composition of
AGB atmospheres. Here we use a recently developed code and an updated thermochemical …

The UMIST database for astrochemistry 2022

TJ Millar, C Walsh, M Van de Sande… - Astronomy & …, 2024 - aanda.org
Context. Detailed astrochemical models are a key component to interpret the observations of
interstellar and circumstellar molecules since they allow important physical properties of the …

Discovery of two new magnesium-bearing species in IRC+ 10216: MgC3N and MgC4H

J Cernicharo, C Cabezas, JR Pardo… - Astronomy & …, 2019 - aanda.org
We report on the detection of two series of harmonically related doublets in IRC+ 10216.
From the observed frequencies, the rotational constant of the first series is B= 1380.888 MHz …

Discovery of two metallic cyanoacetylides in IRC+ 10216: HMgCCCN and NaCCCN

C Cabezas, JR Pardo, M Agúndez, B Tercero… - Astronomy & …, 2023 - aanda.org
We report on the detection of a series of six lines in the ultra-deep Q-band integration
towards IRC+ 10216 carried out with the Yebes 40 m telescope, which are in harmonic …