Lv5
1010 积分 2021-11-23 加入
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
28天前
已完结
REST: Embracing the rust programming language for modern electronic structure theory
2个月前
已关闭
An effective exchange potential for the Hartree-fock ground state energy in a solid
4个月前
已关闭
A linear cobalt(II) complex with maximal orbital angular momentum from a non-Aufbau ground state
4个月前
已完结
Metal-organic framework MIL-101(Fe)–NH2 as an efficient host for sulphur storage in long-cycle Li–S batteries
8个月前
已完结
MOF [NH2-MIL-101(Fe)] as a powerful and reusable Fenton-like catalyst
8个月前
已完结
Free-Radical and Non-Free-Radical Based Reaction Pathways of Iodide Oxidation by Hydrogen Peroxide in Acid Solution–Ab Initio Calculations
8个月前
已完结
Magnetic Shielding of Nuclei in Molecules
10个月前
已完结
Relativistic Theory of EPR and (p)NMR
10个月前
已完结
络合物稳定常数及有机试剂纯度的光度法测定
10个月前
已完结
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