Simulating X-ray Absorption Spectroscopy in Challenging Environments: Methodological Insights from Water-Solvated Ammonia and Ammonium Systems-Reference-Cited by-同舟云学术

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Simulating X-ray Absorption Spectroscopy in Challenging Environments: Methodological Insights from Water-Solvated Ammonia and Ammonium Systems

Published:2024-04-30 Issue:9 Volume:20 Page:3406-3412
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Larsson Ernst Dennis¹^ORCID,Jørgensen Frederik Kamper¹^ORCID,Reinholdt Peter¹^ORCID,Hedegård Erik Donovan¹^ORCID,Kongsted Jacob¹^ORCID

Affiliation:

1. Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, Campusvej 55 , DK-5230 Odense M, Denmark

Funder

Danmarks Frie Forskningsfond

Novo Nordisk Fonden

Villum Fonden

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.4c00088

Reference40 articles.

1. A liquid flatjet system for solution phase soft-x-ray spectroscopy

2. Soft X-ray Absorption Spectroscopy of Aqueous Solutions Using a Table-Top Femtosecond Soft X-ray Source

3. Nitrogen K-Edge X-ray Absorption Spectra of Ammonium and Ammonia in Water Solution: Assessing the Performance of Polarizable Embedding Coupled Cluster Methods

4. Photoemission from Liquid Aqueous Solutions

5. Soft X-ray Absorption Spectroscopy of Liquids and Solutions

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