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2. A.N. Frumkin Institute of Physical Chemistry and Electrochemistry of Russian Academy of Science, 119071 Moscow, Russia


Theoretical, Quantum and Computational Chemistry
Topic Information
Dear Colleagues,
Theory and computation are crucial parts of modern chemical research since they drive and stimulate investigations by proposing testable hypotheses, as well as providing explanations for chemical observations in terms of fundamental principles. Theoretical, quantum, and computational chemistry are based on a rigorous mathematical or simulational approach to problems of chemical, physical, or biological interest. This Topic is focused on advances in the fundamental research and application of theoretical, quantum, and computational chemistry. Submissions concerning, but not limited to, the following general areas are encouraged.
- Bioanalytical sciences;
- Chemical reactivity simulation;
- D and f-element molecular magnetism modelling;
- Density functional theory;
- Theoretical spectroscopy;
- Femtochemistry;
- Electronic structure theory;
- Partition function for studying multimolecular systems;
- Protein structure and function;
- Atmospheric chemistry;
- Nanotechnology;
- Molecular quantum dynamics;
- Quantum chemical topology;
- Quantum mechanical study of inorganic molecular chemistry;
- Quantum mechanics in biological processes.
Dr. Andrei L. Tchougréeff
Dr. Rubicelia Vargas
Dr. Jorge Garza
Topic Editors
Keywords
- theoretical chemistry
- quantum chemistry
- computational chemistry
- density functional theory
- molecular quantum dynamics
- bioanalytical sciences
- material science
Participating Journals
Journal Name | Impact Factor | CiteScore | Launched Year | First Decision (median) | APC |
---|---|---|---|---|---|
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Applied Sciences
|
2.5 | 5.3 | 2011 | 18.4 Days | CHF 2400 |
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Inorganics
|
3.1 | 2.8 | 2013 | 15.8 Days | CHF 2200 |
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Molecules
|
4.2 | 7.4 | 1996 | 15.1 Days | CHF 2700 |
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Quantum Reports
|
- | 3.3 | 2019 | 16.4 Days | CHF 1400 |
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Symmetry
|
2.2 | 5.4 | 2009 | 17.3 Days | CHF 2400 |
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International Journal of Molecular Sciences
|
4.9 | 8.1 | 2000 | 16.8 Days | CHF 2900 |
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