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20142017
most citedStructural Stability and Defect Energetics of ZnO from Diffusion Quantum Monte Carlo

62 citations · 178 across the 4 of their papers we have counts for

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Showing 2016 · cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2016★ 39 cited

Cohesive energy and structural parameters of binary oxides of groups IIA and IIIB from diffusion quantum Monte Carlo

Juan A. Santana, Jaron T. Krogel, Paul R. C. Kent +1

We have applied the diffusion quantum Monte Carlo (DMC) method to calculate the cohesive energy and the structural parameters of the binary oxides CaO, SrO, BaO, Sc2O3, Y2O3 and La…