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Jellyfish: A modular code for wave function‐based electron dynamics simulations and visualizations on traditional and quantum compute architectures.
- Published in:
- WIREs: Computational Molecular Science, 2024, v. 14, n. 1, p. 1, doi. 10.1002/wcms.1696
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- Article
Three-Electron Dynamics of the Interparticle Coulombic Decay in Doubly Excited Clusters with One-Dimensional Continuum Confinement.
- Published in:
- Molecules, 2022, v. 27, n. 24, p. 8713, doi. 10.3390/molecules27248713
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- Article
A user‐friendly, Python‐based quantum mechanics/Gromacs interface: gmx2qmmm.
- Published in:
- International Journal of Quantum Chemistry, 2021, v. 121, n. 3, p. 1, doi. 10.1002/qua.26486
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- Article