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20172025
most citedOn Achieving High Accuracy in Quantum Chemical Calculations of 3d Transition Metal Systems: A Comparison of Auxiliary-Field Quantum Monte Carlo with Coupled Cluster, Density Functional Theory, and Experiment for Diatomic Molecules

92 citations · 344 across the 13 of their papers we have counts for

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cond-mat.mtrl-sci2019★ 11 cited

Transitions in ZnS and CdSe quantum dots and wave-function symmetry

B. Zorman, R. A. Friesner

Excitation energies for wurtzite spherical ZnS and CdSe quantum dots in the range of 40-4000 atoms were calculated using empirical pseudopotentials and a real-space basis. The ener…