Overview of Developments in the MRCC Program System

mrcc is a versatile suite of quantum chemistry programs designed for accurate and density functional theory (DFT) calculations. This contribution outlines the general features and recent developments of the package. The most popular features include the open-ended coupled-cluster (CC) code, state-of...

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Bibliographic Details

Published in:	The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory Vol. 129; no. 8; p. 2086
Main Authors:	Mester, Dávid, Nagy, Péter R, Csóka, József, Gyevi-Nagy, László, Szabó, P Bernát, Horváth, Réka A, Petrov, Klára, Hégely, Bence, Ladóczki, Bence, Samu, Gyula, Lőrincz, Balázs D, Kállay, Mihály
Format:	Journal Article
Language:	English
Published:	United States 27.02.2025
ISSN:	1520-5215, 1520-5215
Online Access:	Get more information
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