A generalized method for the inversion of cohesive energy curves from isotropic and anisotropic lattice expansions
Author:
Affiliation:
1. Chemical and Materials Engineering Department
2. University of Nevada-Reno
3. Reno
4. USA
Abstract
Cohesive energy inversions are generalized to handle a broad range of lattice geometries, including systems with internal rigid bodies.
Funder
Division of Materials Research
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2015/CP/C5CP03792A
Reference25 articles.
1. Multiple lattice inversion approach to interatomic potentials for compound semiconductors
2. Interatomic potentials and atomistic calculations of some metal hydride systems
3. Prediction of the lowest-energy structures of actinide-series metal clusters using Möbius inversion pair potentials
4. Interatomic potentials between distinct atoms from first-principles calculation and lattice-inversion method
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