21 results on '"Sodt, Alex"'
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2. Auxiliary Basis Expansions for Large-Scale Electronic Structure Calculations
3. Driving Forces for Transmembrane α-Helix Oligomerization
4. Driving forces for transmembrane alpha-helix oligomerization.
5. An implicit solvent coarse-grained lipid model with correct stress profile
6. Unrestricted perfect pairing: The simplest wave-function-based model chemistry beyond mean field
7. Deciphering Nanometer-Scale Lipid Structure and Physics to Model Membrane Reshaping
8. Hartree-Fock exchange computed using the atomic resolution of the identity approximation.
9. The limits of local correlation theory: Electronic delocalization and chemically smooth potential energy surfaces.
10. Linear scaling density fitting.
11. A near linear-scaling smooth local coupled cluster algorithm for electronic structure.
12. Predicting accurate electronic excitation transfer rates via Marcus theory with Boys or Edmiston-Ruedenberg localized diabatization
13. The Molecular Structure of the Liquid Ordered Phase
14. Lipid Mechanical Properties from Computer Simulation
15. The Lateral Stress Profiles of Lipid Bilayers Compared with Spontaneous Lipid Curvature Using Computer Simulations
16. Predicting Accurate Electronic Excitation Transfer Rates via Marcus Theory with Boys or Edmiston−Ruedenberg Localized Diabatization†
17. Localized orbital theory and ammonia triborane
18. A Fast Implementation of Perfect Pairing and Imperfect Pairing Using the Resolution of the Identity Approximation
19. Advances in methods and algorithms in a modern quantum chemistry program package
20. Fast electronic structure methods for strongly correlated molecular systems
21. Auxiliary basis expansions for large-scale electronic structure calculations.
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