Comprehensive Benchmarking of a Density-Dependent Dispersion Correction-Reference-Cited by-同舟云学术

Comprehensive Benchmarking of a Density-Dependent Dispersion Correction

Published:2011-10-18 Issue:11 Volume:7 Page:3567-3577
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Steinmann Stephan N.¹,Corminboeuf Clemence¹

Affiliation:

1. Laboratory for Computational Molecular Design, Institut des Sciences et Ingénierie Chimiques, Ecole Polytechnique Fédérale de Lausanne, CH-1015 Lausanne, Switzerland

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct200602x

Reference178 articles.

1. Stabilization Energies of the Hydrogen-Bonded and Stacked Structures of Nucleic Acid Base Pairs in the Crystal Geometries of CG, AT, and AC DNA Steps and in the NMR Geometry of the 5‘-d(GCGAAGC)-3‘ Hairpin: Complete Basis Set Calculations at the MP2 and CCSD(T) Levels

2. Determinants of a protein fold

3. Crystal Engineering: from Structure to Function

4. Role of Electrostatic Interactions in Determining the Crystal Structures of Polar Organic Molecules. A Distributed Multipole Study

5. Inorganic crystal engineering: a personal perspective

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