Computer Simulation in Condensed Matter Research Group. SIMCON

Interdisciplinary topics

  1. Alvarez-Galera, E.; Laria, D.; Mazzanti, F.; Batet, L.; Martí, J. (2025) Henry's constant of helium in liquid lead-lithium alloys, J.Mol.Liq. 432, 127719 (8 pages). https://doi.org/10.1016/j.molliq.2025.127719
  2. Prat Pou, Arnau; Romero, E.; Martí, J.-; Mazzanti, F. (2025) Mean field initialization of the annealed importance sampling algorithm for an efficient evaluation of the partition function using restricted boltzmann machines, Entropy 27, 171 (18 pages). https://doi.org/10.3390/e27020171
  3. Alvarez-Galera, E.; Laria, D.; Batet, L.; Martí, J. (2024) Henry's constant of helium in liquid alkali metals, J.Mol.Liq. 395, 123853 (7 pages). https://doi.org/10.1016/j.molliq.2023.123853
  4. Alvarez-Galera, E.; Martí, J.; Mazzanti, F.; Batet, L. (2023) Nucleation of helium in pure liquid lithium, J.Chem.Phys.159, 024501 (10 pages). DOI: 10.1063/5.0152704
  5. Marti, J.; Mazzanti,F.; Astrakharchik,G.E.; Batet,L.; Portos-Amill,L.; Pedreño, B.(2022) Nucleation of helium in liquid lithium at 843 K and high pressures, Materials 15, 2866 (18 pages).
  6. Marti,J., Diaz, B. (2020) Efficient recursive Adams–Bashforth methods in molecular dynamics simulations of N-body systems interacting through pairwise potentials, Molecular Simulation, pp 1-7 DOI: 10.1080/08927022.2020.1815730
  7. Rodriguez, J., Elola, M.D., Marti, J., Laria, D. (2017) Surface behavior of aprotic mixtures: dimethylsulfoxide/acetonitrile. J.Phys.Chem.C 121,14618-14627
  8. Tahat, A.; Marti, J.; Tahat, K.; Khwaldeh, A. AJAC: atomic data calculation tool in Python. Chinese Physics B 22, pp. 048901-1 - 048901-13 (2013).
  9. Khwaldeh, A.; Tahat, A.; Marti, J.; Tahat, M. Atomic data mining numerical methods, source code SQlite with Python. Procedia - Social and behavioral sciences 73, pp. 232 - 239 (2013).
  10. Khwaldeh, A.; Tahat, A.; Marti, J. Software refactoring: solving the time-dependent Schrodinger equation via fast Fourier transforms and parallel programming. Journal of applied sciences 12, pp. 2115 - 2127 (2012).
  11. Khwaldeh, A.; Tahat, A.; Marti, J.; Tahat, M. Maintenance and reengineering of software: creating a Visual C++ graphical user interface to perform specific tasks related to soil structure interaction in poroelastic soil. Information technology journal 11, pp. 1553 - 1569 (2012).
  12. Guardia, E.; Marti, J.; Padro, J.; Saiz, L.; Komolkin, A. Dynamics in hydrogen-bonded liquids: water and alcohols. Journal of molecular liquids 96, pp. 3 - 17 (2002).
  13. Marti, J.; Padro, J.; Guardia, E. Hydrogen bonding influence on the intermolecular vibrational spectra of liquid methanol. Journal of molecular liquids 64, pp. 12647 - 12654 (1995).