标准化电场分辨分子指纹

Marinus Huber, M. Trubetskov, W. Schweinberger, P. Jacob, M. Žigman, F. Krausz, I. Pupeza
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引用次数: 0

摘要

红外(IR)振动光谱是一种广泛应用的流行工具,因为它能够从几乎任何样品中获得无标签的化学信息[1],[2]。红外光谱广泛使用的一个重要方面是,经过仔细测量和处理,红外光谱在很大程度上与仪器无关,因此具有可比性。这使得包含许多化学光谱的数据库能够组装起来,例如,通过化学计量方法来识别和量化样品中的未知物质。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Standardising Electric-Field-Resolved Molecular Fingerprints
Infrared (IR) vibrational spectroscopy is a popular tool for a wide range of applications due to its ability to obtain label-free chemical information from virtually any sample [1], [2]. An important aspect for its widespread use is that IR spectra, when carefully measured and processed, are largely instrument-independent, and thus comparable. This has enabled the assembly of databases containing numerous spectra of chemicals, which are being used, e.g., to identify and quantify unknown substances in samples via chemometric approaches.
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CiteScore
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