Work

Efficient and Accurate Methods for the Geometry Optimization of Water Clusters: Application of Analytic Gradients for the Two-Body:Many-Body QM:QM Fragmentation Method to (H2O)n, n = 3–10

Year: 2011

Type: article

Source: Journal of Chemical Theory and Computation

DOI: 10.1021/ct200176t

Authors: Desiree M. Bates, Joshua R. Smith, Gregory S. Tschumper

Institution: University of Mississippi

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

OpenAlex ID: W2322603786

FWCI: 3.472

Cites: 58

Cited by: 62

Related to: 10