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All-Electron Monte Carlo Calculations on Heavy Atom Systems
https://doi.org/10.1142/9789812819710_0010Cited by:1 (Source: Crossref)
Abstract:
The following sections are included:
Challenge of heavy-atom systems
Monte Carlo calculations on heavy atom systems
Some sampling methods for all electron simulations on large-Z systems
“split-tau’ technique
Diffusion-only Metropolis sampling
Core-valence partitioning schemes
Spectroscopic properties
Acknowlegements
References
