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Papers matching “quantum field theory simulation” 5

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Dissociation behavior of photocatalyst-substrate complexes investigated with quantum mechanically derived force-fields
2026 ChemRxiv preprint Chemistry Photochemistry and Electron Transfer Studies Open access

Gereon Feldmann, Christoph Bannwarth

0

citations
Time-resolved investigation of photocatalytic allene deracemization with kinetic modeling and force-field-based molecular dynamics
2026 ChemRxiv preprint Chemistry Photochemistry and Electron Transfer Studies Open access

Gereon Feldmann, Christoph Bannwarth

0

citations
Phase transitions in the spin-1/2 Heisenberg antiferromagnet on the dimerized diamond lattice
2024 arXiv (Cornell University) preprint Physics and Astronomy Advanced Condensed Matter Physics Open access

Ronja Bärwolf, Alexander Sushchyev, Francesco Parisen Toldin, Stefan Weßel

0

citations
Nonperturbative Nonlinear Transport in a Floquet-Weyl Semimetal
2024 arXiv (Cornell University) preprint Physics and Astronomy Topological Materials and Phenomena Open access

Matthew W. Day, Kateryna Kusyak, Felix P. Sturm, Juan Aranzadi, Hope Bretscher, M. Fechner, +20 more

4

citations
Multimap targeted free energy estimation
2023 arXiv (Cornell University) preprint Computer Science Computational Drug Discovery Methods Open access

Andrea Rizzi, Paolo Carloni, Michele Parrinello

3

citations

5 results