@inproceedings{fc6ad147bac64466aeb0756c858ab0ce,
title = "Interatomic potentials from first-principles calculations",
abstract = "We propose a new scheme to extract `optimal' interatomic potentials starting from a large number of atomic configurations (and their forces) obtained from first-principles calculations. The method appears to be able to overcome the difficulties encountered by traditional fitting approaches when using rich and complex analytical forms, and constitute a step forward towards large-scale simulations of condensed matter systems with a degree of accuracy comparable to that obtained by ab initio methods. A first exploratory application to aluminum is presented.",
author = "Furio Ercolessi and Adams, {James B.}",
year = "1993",
month = jan,
day = "1",
language = "English (US)",
isbn = "1558991867",
series = "Materials Research Society Symposium Proceedings",
publisher = "Publ by Materials Research Society",
pages = "31--36",
booktitle = "Materials Theory and Modelling",
note = "Proceedings of the Materials Research Society Symposium ; Conference date: 30-11-1992 Through 03-12-1992",
}