当前位置: X-MOL 学术Comput. Geosci. › 论文详情
Our official English website, www.x-mol.net, welcomes your feedback! (Note: you will need to create a separate account there.)
FRAnCIs calculation program with universal Raman calibration data for the determination of PVX properties of CO2–CH4–N2 and CH4–H2O–NaCl systems and their uncertainties
Computers & Geosciences ( IF 4.2 ) Pub Date : 2021-07-27 , DOI: 10.1016/j.cageo.2021.104896
Van-Hoan Le 1 , Marie-Camille Caumon 1 , Alexandre Tarantola 1
Affiliation  

Many experimental calibration data linking the variation of Raman spectral parameters (i.e., peak position, peak area/intensity ratio …) with the PVX properties of pure gases or mixtures of CO2–CH4–N2 or CH4–H2O–NaCl systems have been published in literature by different laboratories. However, there is a significant discrepancy between these calibrations, leading possibly to inaccurate results when applied in another laboratory. In this paper, the inter-laboratory applicability of the existing calibration data is examined. Universal calibration data based on 78 regression equations and applicable for any Raman apparatus within any laboratory are provided in the form of a calculation program. The FRAnCIs (acronym for Fluids: Raman Analysis of the Composition of Inclusions) Python user-friendly interface facilitates the application of these calibrations as well as to estimate the uncertainty of the measurements.



中文翻译:

具有通用拉曼校准数据的 FRAnCIs 计算程序,用于测定 CO2–CH4–N2 和 CH4–H2O–NaCl 系统的 PVX 特性及其不确定度

许多实验校准数据将拉曼光谱参数(即峰位置、峰面积/强度比……)的变化与纯气体或 CO 2 –CH 4 –N 2或 CH 4 –H 2混合物的PVX特性联系起来O-NaCl 系统已被不同实验室发表在文献中。但是,这些校准之间存在显着差异,因此在其他实验室应用时可能会导致结果不准确。在本文中,检查了现有校准数据的实验室间适用性。以计算程序的形式提供基于 78 个回归方程并适用于任何实验室内的任何拉曼仪器的通用校准数据。混流(缩写˚F luids:- [R阿曼一个所述的alysis Ç的ompositionnclusion小号) Python 用户友好界面有助于这些校准的应用以及估计测量的不确定性。

更新日期:2021-07-30
down
wechat
bug