npj Computational Materials (NPJCM)

npj Computational Materials is a high-impact, peer-reviewed, fully open-access journal that focuses on the application of computational methods to materials science. The journal publishes cutting-edge research aimed at designing new materials and understanding the properties and behavior of existing ones using theoretical, simulation-based, and data-driven approaches. It covers a wide range of topics including first-principles calculations, molecular dynamics simulations, high-throughput computational screening, and machine learning techniques for materials discovery. The journal also encourages studies that integrate computational predictions with experimental validation, enhancing the reliability and applicability of findings. A key strength of the journal is its focus on “materials by design,” where advanced algorithms and artificial intelligence are used to accelerate innovation in areas such as energy materials, nanotechnology, and sustainable materials. The journal plays an important role in bridging computational science with real-world material applications, contributing to advancements in technology and industry.

npj Computational Materials (NPJCM) is :-

• International, Peer-Reviewed, Open Access, Refereed, Computational Materials Science, Materials Modeling & Simulation, Artificial Intelligence in Materials, Materials Informatics & Data Mining, Physics, Engineering & Applied Mathematics, first-principles calculations, molecular dynamics simulations, high-throughput computational screening, machine learning techniques for materials discovery , Online , Continuously Journal

• UGC Approved, ISSN Approved: P-ISSN E-ISSN: 2057-3960, Established: 2015,
• Does Not Provide Crossref DOI

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