Concepedia

Real-time monitoring of aristolochic acid I reduction process using surface-enhanced Raman Spectroscopy with DFT simulation

Lu Cao, Hongguang Liu, Wen Jun Xie, Shu‐Meng Jiao, Xueqiang Wu, Kaisong Yuan, Xia Zhou, Muzi Yang, Yanyan Guan, Huaihong Cai,

Biosensors and Bioelectronics · 2021 · 12 citations · 46 references

DOI

Concepts

References

46

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

, , +13

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

, , +17

Multiwfn: A multifunctional wavefunction analyzer

Tian Lu, Feiwu Chen · Journal of Computational Chemistry · 2011 · 43K citations

, , +15

An Evaluation of Harmonic Vibrational Frequency Scale Factors

Jeffrey Merrick, Damian Moran, Leo Radom · The Journal of Physical Chemistry A · 2007 · 2.7K citations

, , +17

In situ Raman spectroscopic evidence for oxygen reduction reaction intermediates at platinum single-crystal surfaces

Jin‐Chao Dong, Xia‐Guang Zhang, Valentín Briega‐Martos et al. · Nature Energy · 2018 · 784 citations

, , +16