A Cost-Effective Semi-Ab Initio Approach to Model Relaxation in Rare-Earth Single-Molecule Magnets

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Location: Deutsche Nationalbibliothek Frankfurt am Main

Extent: Online-Ressource

Language: Englisch

Bibliographic citation: In: 10.1021/acs.jpclett.1c02367

Event: Veröffentlichung

(where): Aachen

(who): Universitätsbibliothek der RWTH Aachen

(when): 2021

Creator: Garlatti, Elena
Chiesa, Alessandro
Bonfà, Pietro
Macaluso, Emilio
Onuorah, Ifeanyi J.
Parmar, Vijay S.
Ding, You-Song
Zheng, Yan-Zhen
Giansiracusa, Marcus J.
Reta, Daniel
Pavarini, Eva
Guidi, Tatiana
Mills, David P.
Chilton, Nicholas F.
Winpenny, Richard E. P.
Santini, Paolo
Carretta, Stefano

DOI: 10.18154/RWTH-2021-09653

URN: urn:nbn:de:101:1-2021102203302110836117

Rights: Der Zugriff auf das Objekt ist unbeschränkt möglich.

Last update: 15.08.2025, 7:27 AM CEST

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Associated

Garlatti, Elena
Chiesa, Alessandro
Bonfà, Pietro
Macaluso, Emilio
Onuorah, Ifeanyi J.
Parmar, Vijay S.
Ding, You-Song
Zheng, Yan-Zhen
Giansiracusa, Marcus J.
Reta, Daniel
Pavarini, Eva
Guidi, Tatiana
Mills, David P.
Chilton, Nicholas F.
Winpenny, Richard E. P.
Santini, Paolo
Carretta, Stefano
Universitätsbibliothek der RWTH Aachen

Time of origin

2021

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A Cost-Effective Semi-Ab Initio Approach to Model Relaxation in Rare-Earth Single-Molecule Magnets

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Other Objects (12)

Probing Relaxation Dynamics in Five‐Coordinate Dysprosium Single‐Molecule Magnets

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Prediction of Reactive Nitrous Acid Formation in Rare‐Earth MOFs via ab initio Molecular Dynamics

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Ab initio study of the thermopower of biphenyl-based single-molecule junctions

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