Lv31
350 积分 2023-06-30 加入
Basis Set Limit CCSD(T) Energies for Extended Molecules via a Reduced-Cost Explicitly Correlated Approach
1小时前
待确认
Toward Pair Atomic Density Fitting for Correlation Energies with Benchmark Accuracy
2小时前
已完结
TURBOMOLE: Today and Tomorrow
1天前
已完结
Turbomole
2天前
已完结
Implementation of Real-Time TDDFT for Periodic Systems in the Open-Source PySCF Software Package
2天前
已完结
A DLPNO‐CCSD(T) benchmarking study of intermolecular interactions of ionic liquids
2天前
已完结
High-entropy single-atom activated carbon catalysts for sustainable oxygen electrocatalysis
6天前
已完结
Valorization of waste biodegradable polyester for methyl methacrylate production
6天前
已完结
Importance of the catalyst–water Coulomb interaction for oxygen reduction reaction kinetics
13天前
已完结
Does a Higher Density of Active Sites Indicate a Higher Reaction Rate?
13天前
已完结
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