2 citations · 2 across the 3 of their papers we have counts for
4 papers
Accurate Atomic Correlation Energies and Virial Trends for Correlation-Consistent Effective Core Potentials III: Quantitative Separation of Fixed-Node Biases and Localization Errors in Cs-Rn
Omar Madany, Lubos Mitas
Atomic benchmarks for sixth-period elements (Cs-Rn) are established to sub-millihartree precision under correlation-consistent effective core potentials (ccECPs) using coupled-clus…
A new generation of effective core potentials: Selected heavy 5d and 6p elements
Omar Madany, Lubos Mitas
We expand the correlation-consistent effective core potentials (ccECPs) library by developing semi-local pseudopotentials and matching basis sets by heavy-elements from (Hf, O…
Accurate atomic correlation and total energies for correlation consistent effective core potentials II: Rb-Xe elements
Aqsa Shaikh, Omar Madany, Benjamin Kincaid +1
We employ correlation-consistent effective core potentials (ccECPs) to perform exact or nearly exact correlation and total energy calculations for the fifth-row elements (Rb-Xe). T…
A new generation of effective core potentials: Selected lanthanides and heavy elements II
Omar Madany, Benjamin Kincaid, Aqsa Shaikh +2
We present a new set of correlation-consistent effective core potentials (ccECPs) for selected heavy , , , and -block elements significant in materials science and chem…