Work

Combining data-driven and quantum chemical approaches to evaluate Minnesota functionals (M06-2X, MN12-SX, and MN15) for the enthalpy of formation predictions

Year: 2025

Type: article

Source: Journal of Molecular Modeling

DOI: 10.1007/s00894-025-06583-6

Authors: Ali A. Khairbek, Ali Moulhim, Homam Ibraheem, Abdullah Yahya Abdullah Alzahrani, Pooventhiran Thangaiyan, Renjith Thomas

Institutions: Saveetha University, Beijing Institute of Technology, Latakia University, King Khalid University, Chandigarh University

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: Royal Society of Chemistry

OpenAlex ID: W4416618388

FWCI: 0.276

Cites: 27

Cited by: 1

Related to: 10