Work

Accurate, Affordable and Unsupervised: Analytical F12 Gradients Driven by Generalized Internal Coordinates

Year: 2025

Type: article

Source: The Journal of Physical Chemistry Letters

DOI: 10.1021/acs.jpclett.5c02292

Authors: Luigi Crisci, Federico Lazzari, Vincenzo Barone

Institutions: Scuola Superiore Meridionale, National Interuniversity Consortium of Materials Science and Technology

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: closed

Funder: Gaussian

OpenAlex ID: W4414244707

FWCI: 7.847

Cites: 62

Cited by: 21

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