Research opportunities

 

[ lietuviškai | english ]

  • Research opportunities for PhD
    • Open PhD positions:
      “Influence of Polar Environments on Molecular Aggregation and Near-Infrared (NIR) Absorption Spectra”
      Official PhD call and details

  • Current directions for BSc/MSc students:
    • Quantum chemistry of carotenoids and hydrogen-bond networks
    • Molecular dynamics and hydrogen-bond networks
    • Quantum chemistry and ESP-derived force fields
    • Computational workflows and HPC systems
    • NIR spectroscopy modelling

  • Recent student topics
    • Structure and Raman Spectral Analysis of the β-Cyclodextrin–Apocarotenal Complex Using Density Functional Theory
    • Benchmarking Digital Quantum Computer Simulators on an HPC Environment
    • Modeling of possible complexes of stilbene and other structures using molecular dynamics
    • Carotenoid Structure Analysis Using Quantum Chemistry and Molecular Dynamics Methods