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THEORETICAL CHEMISTRY ACCOUNTS
Rivista
Codice:
E167141
ISSN:
1432-881X
Dati Generali
Dati Generali
Pubblicazioni (5)
Benchmarking density functionals and Gaussian basis sets for calculation of core-electron binding energies in amino acids
Articolo
Comparative study of Gaussian basis sets for calculation of core electron binding energies in first-row hydrides and glycine
Articolo
How polarization damping affects ion solvation dynamics
Articolo
Molecular dynamics simulation of the Pb(II) coordination in biological media via cationic dummy atom models
Articolo
Reactivity of arsenoplatin complex versus water and thiocyanate: a DFT benchmark study
Articolo
No Results Found
