15 results on '"van Dam, Hubertus"'
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2. Achieving performance portability in Gaussian basis set density functional theory on accelerator based architectures in NWChemEx
3. PluginPlay: Enabling exascale scientific software one module at a time.
4. PolyODENet: Deriving mass-action rate equations from incomplete transient kinetics data.
5. Two related families of metal transferases, ZNG1 and ZNG2, are involved in acclimation to poor Zn nutrition in Arabidopsis.
6. Towards large-scale calculations with State-Specific Multireference Coupled Cluster methods: Studies on dodecane, naphthynes, and polycarbenes
7. Massively parallel implementation of the multireference Brillouin–Wigner CCSD method
8. Memorial Viewpoint for Joop van Lenthe.
9. Universal state-selective corrections to multi-reference coupled-cluster theories with single and double excitations.
10. On the suitability of MPI as a PGAS runtime.
11. Building Scalable PGAS Communication Subsystem on Blue Gene/Q.
12. Implementation of the multireference Brillouin-Wigner and Mukherjee's coupled cluster methods with non-iterative triple excitations utilizing reference-level parallelism.
13. Generalization of the Kohn-Sham system that can represent arbitrary one-electron density matrices
14. Theoretical studies of the global minima and polarizabilities of small lithium clusters.
15. Towards large-scale calculations with State-Specific Multireference Coupled Cluster methods: Studies on dodecane, naphthynes, and polycarbenes
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