Erratum: “Phase coexistence in polydisperse liquid mixtures: Beyond the van der Waals approximation” [J. Chem. Phys. 119, 7335 (2003)]

2004 ◽  
Vol 121 (2) ◽  
pp. 1168-1168 ◽  
Author(s):  
Yurij V. Kalyuzhnyi ◽  
Gerhard Kahl
Keyword(s):  
Van Der Waals ◽  
Liquid Mixtures ◽  
Chem Phys ◽  
Phase Coexistence

Beyond the Van Der Waals loop: What can be learned from simulating Lennard-Jones fluids inside the region of phase coexistence

2012 ◽  
Vol 80 (12) ◽  
pp. 1099-1109 ◽  
Author(s):  
Kurt Binder ◽  
Benjamin J. Block ◽  
Peter Virnau ◽  
Andreas Tröster
Keyword(s):  
Van Der Waals ◽  
Phase Coexistence ◽  
Lennard Jones

scholarly journals Benchmarking Several van der Waals Dispersion Approaches for the Description of Intermolecular Interactions

2018 ◽  
Author(s):  
Julien Claudot ◽  
Won June Kim ◽  
Anant Dixit ◽  
Hyungjun Kim ◽  
Tim Gould ◽  
...  
Keyword(s):  
Van Der Waals ◽  
Chem Phys ◽  
Binding Energies ◽  
Van Der Waals Interactions ◽  
Density Functionals ◽  
Many Body ◽  
Blind Test ◽  
Molecular Systems ◽  
Test Sets ◽  
The Many

Seven methods, including three van der Waals density functionals (vdW-DFs) and four different variants of the Tkatchenko-Scheffler (TS) methods, are tested on the A24, L7, and Taylor <i>et al.</i>'s "blind" test sets. It is found that for these systems, the vdW-DFs perform better that the TS methods. In particular, the vdW-DF-cx functional gives binding energies that are the closest to the reference values, while the many body correction of TS does not always lead to an improvement in the description of molecular systems. In light of these results, several directions for further improvements to describe van der Waals interactions are discussed.<br><br>Published as <i>J. Chem. Phys.</i> <b>148</b>, 064112 (2018)<br>

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