H. Werner

发表论文 346 篇 · 总被引 51415 次 · h-index 99

代表论文

The Molpro quantum chemistry package. (2020 · Journal of Chemical Physics · 被引 1003)
Explicitly correlated local coupled‐cluster methods using pair natural orbitals (2018 · WIREs Computational Molecular Science · 被引 202)
Scalable Electron Correlation Methods. 3. Efficient and Accurate Parallel Local Coupled Cluster with Pair Natural Orbitals (PNO-LCCSD). (2017 · Journal of Chemical Theory and Computation · 被引 144)
Second-order MCSCF optimization revisited. I. Improved algorithms for fast and robust second-order CASSCF convergence. (2019 · Journal of Chemical Physics · 被引 125)
Scalable Electron Correlation Methods. 4. Parallel Explicitly Correlated Local Coupled Cluster with Pair Natural Orbitals (PNO-LCCSD-F12). (2017 · Journal of Chemical Theory and Computation · 被引 122)
Scalable Electron Correlation Methods. 5. Parallel Perturbative Triples Correction for Explicitly Correlated Local Coupled Cluster with Pair Natural Orbitals. (2018 · Journal of Chemical Theory and Computation · 被引 119)