Lv1
40 积分 2026-01-29 加入
Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18
25天前
已完结
Ab initiomolecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
5个月前
已完结
Projector augmented-wave method
5个月前
已完结
Generalized Gradient Approximation Made Simple
5个月前
已完结
Ab initiomolecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
5个月前
已完结
Ab initiomolecular dynamics for liquid metals
5个月前
已完结
Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set
5个月前
已完结
Structure-property relationships for covalent triazine-based frameworks: The effect of spacer length on photocatalytic hydrogen evolution from water
6个月前
已完结
Photocatalytic overall reactions over MOFs and COFs
6个月前
已完结
Constructing S-scheme heterojunctions by integrating covalent organic frameworks with transition metal sulfides for efficient noble-metal-free photocatalytic hydrogen evolution
7个月前
已完结
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