Research [ASAP] Development of Real-Time TDDFT Program with k-Point Sampling and DFT + U in a Gaussian and Plane Waves Framework LikeLiked Date: February 8, 2025 Less than 1 MinRead Views: 24 Journal of Chemical Theory and Computation DOI: 10.1021/acs.jctc.4c01515 Source: http://dx.doi.org/10.1021/acs.jctc.4c01515 Tags:Materials Industry FacebookTwitterLinkedinWhatsAppTelegramEmail ALT-Lab-Ad-1ALT-Lab-Ad-2ALT-Lab-Ad-3ALT-Lab-Ad-4ALT-Lab-Ad-5ALT-Lab-Ad-6ALT-Lab-Ad-7ALT-Lab-Ad-8ALT-Lab-Ad-9ALT-Lab-Ad-10ALT-Lab-Ad-11ALT-Lab-Ad-12ALT-Lab-Ad-13 Recent Articles Energy use and carbon emissions in high-performance computing: A case study for universities and reduction strategies Research February 26, 2026 Research February 26, 2026 Recovering acidic solid residues from wet chemical phosphorus recovery of sewage sludge ash in the production of cementitious composites Waste Management February 25, 2026 Solvent selection enables sustainable and affordable lignin biocomposite for cement-free construction Research February 25, 2026 Research February 25, 2026 Current-carrying-coil magnetic field influences methane production in anaerobic digestion of water hyacinth by modulating reactive oxygen species levels Research February 25, 2026 Breaking new ground in sustainability (SD): a novel integrated framework for eco/green-innovation (EI) and green supply chain management (GSCM) implementation in emerging economies –... Research February 25, 2026 10 Best Automotive Paint Technologies That Are Changing Car Design in Dubai and Beyond in 2026 Built Environment February 25, 2026 [ASAP] Hollow Mesoporous Manganese Dioxide Nanoprobes for Hepatocellular Carcinoma Diagnosis and Therapy Research February 25, 2026 A tough Supreme Court hearing brings little clarity on Line 5 pipeline’s fate Energy February 25, 2026 Load more
