Gaussian Approximation Potentials for iron from extended first-principles dat...
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Interatomic potentials are often necessary to describe complex realistic systems that would be too costly to study from first-principles. Commonly, interatomic potentials are...
原子间势(interatomic potentials)通常是描述复杂真实体系的必要手段,这类体系若通过第一性原理开展研究往往成本过高。通常而言,原子间势……



