↓ Skip to Main Content
Dral's Group AI-enhanced computational chemistry | LOOKING FOR POSTDOCS WITH DIFFERENT EXPERTISE (QM AND ML METHOD DEVELOPMENT, SOLID-STATE MEHOD DEVELOPMENT, APPLICATIONS AND MORE)

Main Navigation

  • Group
  • About Pavlo
    • Contact and Legal Notice
    • Privacy Statement
    • Cookie Policy
  • People
  • Publications
  • Research
  • Online Course
  • Conferences
  • News & Posts
    • News
    • Posts
Dral's Group AI-enhanced computational chemistry | LOOKING FOR POSTDOCS WITH DIFFERENT EXPERTISE (QM AND ML METHOD DEVELOPMENT, SOLID-STATE MEHOD DEVELOPMENT, APPLICATIONS AND MORE)

Off Canvas Menu

  • Group
  • About Pavlo
    • Contact and Legal Notice
    • Privacy Statement
    • Cookie Policy
  • People
  • Publications
  • Research
  • Online Course
  • Conferences
  • News & Posts
    • News
    • Posts

Author: Lina Zhang

Methane Conversion via Photo-Driven Nitration
Electronic Structure Calculations, Electronic Structure Calculations, News

Methane Conversion via Photo-Driven Nitration

Lina Zhang Jul 10, 2023 Tagged with DFT, excited states, publications

Activation of methane and its conversion to added-value products is an important topic which requires chemical …

Methane Conversion via Photo-Driven Nitration Read more →

Electronic Structure Calculations, Machine Learning in Chemistry, News

VIB5 database with accurate ab initio quantum chemical molecular potential energy surfaces

Lina Zhang Mar 14, 2022 Tagged with database, dataset, PES, publications, Sci. Data

We report global potential energy surfaces (PESs) database VIB5 of 5 molecules of astrophysical interest which …

VIB5 database with accurate ab initio quantum chemical molecular potential energy surfaces Read more →

News

Welcome New Members of Our Group!

Lina Zhang Sep 15, 2021 Tagged with new members, welcome

Fuchun Ge, Ran Wang, and Linqiang Wei join our group starting this month. Welcome! Fuchun officially …

Welcome New Members of Our Group! Read more →

Job Offers, News

Open PhD and Master Positions in 2022

Lina Zhang Sep 15, 2021 Tagged with master position, phD position

The group of Dr. Pavlo Dral in College of Chemistry and Chemical Engineering at Xiamen University …

Open PhD and Master Positions in 2022 Read more →

Copyright © 2026 Dr. Pavlo O. Dral | Powered by Responsive Theme
Copyright © 2026 Dr. Pavlo O. Dral | Powered by Responsive Theme