24 citations · 39 across the 6 of their papers we have counts for
6 papers
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…
A new generation of effective core potentials: selected Lanthanides and heavy elements
Haihan Zhou, Benjamin Kincaid, Guangming Wang +3
We construct correlation-consistent effective core potentials (ccECPs) for a selected set of heavy atoms and f-elements that are of significant current interest in materials and ch…
Correlation consistent effective core potentials for late 3d transition metals adapted for plane wave calculations
Benjamin Kincaid, Guangming Wang, Haihan Zhou +1
We construct a new modification of correlation consistent effective potentials (ccECPs) for late elements Cr-Zn with Ne-core that are adapted for efficiency and low energy cut…
A new generation of effective core potentials from correlated and spin-orbit calculations: selected heavy elements
Guangming Wang, Benjamin Kincaid, Haihan Zhou +4
We introduce new correlation consistent effective core potentials (ccECPs) for the elements I, Te, Bi, Ag, Au, Pd, Ir, Mo, and W with , , and valence spaces. Thes…
A quantum Monte Carlo study of systems with effective core potentials and node nonlinearities
Haihan Zhou, Anthony Scemama, Guangming Wang +4
We study beryllium dihydride (BeH) and acetylene (CH) molecules using real-space diffusion Monte Carlo (DMC) method. The molecules serve as perhaps the simplest prototy…