OAFI - Basile Curchod - EPSRC Programme Grant - UCL lead: A Universal Approach to Using Quantum Dynamics for Real World Problems: Applying Coherent States for MolecularDynamics Simulations (COSMOS)

Curchod, Basile F E (Principal Investigator)

School of Chemistry

Status	Active
Effective start/end date	1/10/23 → 30/09/29

8 Article (Academic Journal)

On the connection between the exact factorization and the Born–Huang representation of the molecular wavefunction
Schürger, P., Lassmann, Y., Agostini, F. & Curchod, B. F. E., 15 May 2025, In: The Journal of Chemical Physics. 162, 19, 1 p., 196101.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
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9 Downloads (Pure)
Selecting Initial Conditions for Trajectory-Based Nonadiabatic Simulations
Janoš, J., Slavíček, P. & Curchod, B. F. E., 21 Jan 2025, In: Accounts of Chemical Research. 58, 2, p. 261-270 10 p.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
2 Citations (Scopus)
Exploring the Influence of Approximations for Simulating Valence Excited X-ray Spectra
Penfold, T. J. & Curchod, B. F. E., 19 Dec 2024, In: The Journal of Physical Chemistry A. 128, 50, p. 10826-10836 11 p.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
2 Citations (Scopus)