NH3 line broadening coefficients and intensities measurement and impurities determination in emerging applications: CCUS, Biomethane and H2.

ABSTRACT

A mid-infrared quantum cascade laser (Mid-IR QCL) coupled with a Single Pass Cell and a Multi Pass Cell, was utilized to measure ammonia (NH3) absorption spectroscopic parameters and determine NH3 impurities toward three emerging applications. We for the first time measured the pressure broadening coefficients perturbed by Air, O2, N2, He, CO2, CH4, and H2 and the line intensities of six NH3 transition lines near 1084.6 cm-1. The measured NH3-He, NH3-Air, and NH3-CO2 broadening coefficients align with HITRAN database, while NH3-H2 coefficients exhibit a maximum discrepancy of 46 %. Deviations between the measured line intensities and HITRAN database are minimal. Nevertheless, the uncertainties of line intensities have been significantly reduced from 20 % in HITRAN to below 3 %. The newly measured line parameters are utilized to address NH3 impurity requirements outlined in CCUS (ISO 279132016), Biomethane (EN 167232016), and H2 (ISO 146872019) standards. Based on the concept of optical gas standard (OGS), the NH3 impurity detection requirements in all three standards have been fulfilled with an uncertainty of 1.35 %. The precision of the NH3-OGS is 800 part per trillion (ppt) with an integration time of 100 s. The repeatability of the NH3-OGS is 130 ppt for a continuous measurement time of 48 min. Notably, the NH3-OGS effectively addresses the highly nonlinear adsorption-desorption dynamics, underscoring the potential of OGS as a calibration-free and SI-traceable metrological gas analysis instrument.