Computational and Theoretical Chemistry (CTC)

Computational and Theoretical Chemistry is an international peer‑reviewed scientific journal that publishes high‑quality research articles and reviews in the field of computational and theoretical chemistry. The journal emphasizes work that advances understanding of molecular and condensed matter systems through rigorous computational methods and theory. Topics commonly covered include electronic structure theory, thermodynamics and kinetics, reaction mechanisms, catalyst modelling, interaction potentials, energetics, weak interactions, dynamics of molecules and clusters, and algorithm development for quantum chemistry and statistical methods. Studies that introduce novel computational approaches, detailed assessments of existing methods, and applications to significant chemical problems are particularly welcomed. This journal serves theoretical chemists, computational scientists, physicists, and interdisciplinary researchers who apply modelling and simulation to chemical challenges across materials, biological systems, catalysis, and nanoscience. Formerly known as Journal of Molecular Structure: THEOCHEM, it adopted its current title in 2011 and has since continued to publish impactful scientific work at the forefront of theory‑driven chemical research. Through rapid editorial processing and broad indexing in citation databases, Computational and Theoretical Chemistry supports dissemination of cutting‑edge theoretical insights and methodological advancements that underpin modern chemical modelling.

Computational and Theoretical Chemistry (CTC) is :-

• International, Peer-Reviewed, Open Access, Refereed, Condensed Matter Physics, Physical and Theoretical Chemistry, Biochemistry, electronic structure, properties, energetics, weak interactions, mechanisms, thermodynamics and kinetics of reactions including catalytic reactions, and excitations including ultra-fast processes, involving atoms, molecules, clusters, surfaces, bulk matter, electronic structure theory, thermodynamics and kinetics, reaction mechanisms, catalyst modelling, interaction potentials, dynamics of molecules and clusters, algorithm development for quantum chemistry and statistical methods , Online or Print , Bi-Weekly Journal

• UGC Approved, ISSN Approved: P-ISSN P-ISSN: 2210-271X, E-ISSN: 2210-2728, Established: 2011, Impact Factor: 2.8
• Does Not Provide Crossref DOI

• Not indexed in Scopus, WoS, DOAJ, PubMed, UGC CARE