Author

David R. David

h-index 0 View on Semantic Scholar

We have 1 of 1 papers

We haven’t gathered this author’s papers yet. Follow them and we’ll fetch their work.

Not the right person? Other researchers publish under this name.

Preprint Jul 2026

Sample-based quantum diagonalization approach for open-shell transition-metal complexes in gas and implicit-solvent

Open-shell $3d$ transition-metal complexes challenge electronic-structure methods because competing spin states, charge transfer, and solvation jointly determine their energetics. Here, we combine sample-based quantum diagonalization (SQD) with the integral-equation-formalism polarizable continuum model (IEF-PCM), exte...

David R. David, Vedangi Pathak, Marek Kowalik et al. · 0 citations