Virtual Special Issue: Methods, Algorithms, Codes, and Software for Theoretical and Computational Chemistry
Theoretical and computational chemistry has made a significant impact on many fields of chemistry, physics, biology, and materials science. Thanks to tremendous advances in different levels of theories, algorithms and their efficient implementations, chemists can now use a diverse arsenal of software to solve various problems. This Virtual Special lssue in Chinese Journal of Chemical Physics, dedicated to the 15th National Congress of Theoretical and Computational Chemistry (NCTCC), will focus on the latest development of theories, algorithms, codes and software in all aspects of theoretical and computational chemistry.
Theoretical and computational chemistry has made a significant impact on many fields of chemistry, physics, biology, and materials science. Thanks to tremendous advances in different levels of theories, algorithms and their efficient implementations, chemists can now use a diverse arsenal of software to solve various problems. This Virtual Special lssue in Chinese Journal of Chemical Physics, dedicated to the 15th National Congress of Theoretical and Computational Chemistry (NCTCC), will focus on the latest development of theories, algorithms, codes and software in all aspects of theoretical and computational chemistry.Topics covered include, but are not limited to:
- Electronic structure theory
- Gas phase dynamics and molecular spectroscopy
- Quantum and classical dynamics of condensed phase systems
- Excited states and nonadiabatic processes
- Surfaces, interfaces, catalysis and materials
- Simulations of biomolecules, polymers, and other complex systems
- Machine learning
- Quantum computing
Guest Editors:
Ganglong Cui, Beijing Normal University
Igor Ying Zhang, Fudan University
Bin Jiang, University of Science and Technology of China
Hujun Qian, Jilin University
Manuscript Submission, Review and Publication Process:
All manuscripts can be submitted via online ScholarOne submission system. All articles will be peer-reviewed as regular articles of CJCP by qualified reviewers, decisions will be made as rapidly as possible, All accepted articles will be published online after proof reading and formatting process. Following online publication, a paper will be published in the next issue for hard copy.