Quantum mechanical calculations are routinely used as a major support in mid-infrared (MIR) and Raman spectroscopy. In contrast, practical limitations for long time formed a barrier to developing a similar synergy between near-infrared (NIR) spectroscopy with...
CITATION STYLE
Bec, K. B., Grabska, J., & Huck, C. W. (2022). The New Avenue – Theoretical Simulation of NIR Spectra and its Potential in Analytical Applications. In Sense the Real Change: Proceedings of the 20th International Conference on Near Infrared Spectroscopy (pp. 32–46). Springer Nature Singapore. https://doi.org/10.1007/978-981-19-4884-8_3
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