Spectroscopic and imaging considerations of THz-TDS and ULF-Raman techniques towards practical security applications.

Nitrogen-containing high-energy organic compounds represent a class of materials with critical implications in various fields, including military, aerospace, and chemical industries. The precise characterization and analysis of these compounds are essential for both safety and performance considerations. Spectroscopic characterization in the far-infrared region has great potential for non-destructive investigation of high energetic and related compounds. This research article presents a comprehensive study of common organic energetic materials in the far-infrared region (5-200 cm-1), aiming to enhance security measures through the utilization of cutting-edge spectroscopic techniques. Broadband terahertz time-domain spectroscopy and ultra-low frequency Raman spectroscopy are employed as powerful tools to probe the vibrational and rotational modes of various explosive materials. One of the key objectives of this present work is unveiling the characteristic spectral features and optical parameters of five common nitrogen based high energy organic compounds towards rapid and accurate identification. Further, we have explored the potential of terahertz reflection imaging for non-contact through barrier sensing, a critical requirement in security applications. Based on the spectral features obtained from the spectroscopic studies and using advanced imaging algorithms we have been able to detect these compounds under various barriers including paper, cloth, backpack, etc. Subsequently, this study highlights the capabilities of the two techniques offering a pathway to enhance their utility over a wide range of practical security applications.

Coherent terahertz laser feedback interferometry for hydration sensing in leaves.

The response of terahertz to the presence of water content makes it an ideal analytical tool for hydration monitoring in agricultural applications. This study reports on the feasibility of terahertz sensing for monitoring the hydration level of freshly harvested leaves of Celtis sinensis by employing a imaging platform based on quantum cascade lasers and laser feedback interferometry. The imaging platform produces wide angle high resolution terahertz amplitude and phase images of the leaves at high frame rates allowing monitoring of dynamic water transport and other changes across the whole leaf. The complementary information in the resulting images was fed to a machine learning model aiming to predict relative water content from a single frame. The model was used to predict the change in hydration level over time. Results of the study suggest that the technique could have substantial potential in agricultural applications.

Comparison of Physical and System Factors Impacting Hydration Sensing in Leaves Using Terahertz Time-Domain and Quantum Cascade Laser Feedback Interferometry Imaging.

To reduce the water footprint in agriculture, the recent push toward precision irrigation management has initiated a sharp rise in photonics-based hydration sensing in plants in a non-contact, non-invasive manner. Here, this aspect of sensing was employed in the terahertz (THz) range for mapping liquid water in the plucked leaves of Bambusa vulgaris and Celtis sinensis. Two complementary techniques, broadband THz time-domain spectroscopic imaging and THz quantum cascade laser-based imaging, were utilized. The resulting hydration maps capture the spatial variations within the leaves as well as the hydration dynamics in various time scales. Although both techniques employed raster scanning to acquire the THz image, the results provide very distinct and different information. Terahertz time-domain spectroscopy provides rich spectral and phase information detailing the dehydration effects on the leaf structure, while THz quantum cascade laser-based laser feedback interferometry gives insight into the fast dynamic variation in dehydration patterns.

Orientational deformations leading to temperature-induced structural phase transition in Prehnite using Raman, Infrared, and Terahertz spectroscopy.

Understanding molecular and structural properties of naturally extracted minerals under varying thermodynamic parameters such as pressure (P) and temperature (T) helps us to explore vital information regarding various geological processes. Here, we present the comprehensive results of Raman, infrared (IR), and Terahertz (THz) spectroscopic investigations on Prehnite (Ca2Al(AlSi3O10)(OH)2) mineral from ambient (25 °C) to 1000 °C in the 6.6 - 4000 cm-1 wide spectral range. The results indicate a substantial distortion in orientation between AlO6 octahedron and SiO4 tetrahedron layer leads to the strengthening of hydrogen bonds (HBs) in the Prehnite structure around 800 °C. Consequently, the disappearance of Raman active modes and abrupt change in frequency (ω) of Far-IR modes (obtained using THz spectroscopy) around 800 °C are spectral signatures of symmetry change in the structure. Eventually, these orientational changes at the molecular level trigger structural phase transition around 800 °C, supported by X-ray diffraction (XRD) measurements. Thus, the present study depicts the pivotal role of inter- and intra-molecular interactions in Prehnite, which determines its bonding and structural characteristics and hence its physicochemical properties under diverse environments.

Dual spectroscopic detection of THz energy modes of critical chemical compounds.

Precise identification and sensing of organic and inorganic molecular systems are key factors in several applications in present industrial and scientific domains. While high energy modes, due to electronic interactions, are mostly impervious to the initial thermodynamic or chemical conditions, the low energy modes are sensitive to such alterations which makes them suitable for quality control purpose with sensitive spectral identification methods. Here we report for the first time, several low frequency peaks of specific nitrogen-based compounds and their derivatives, using the dual spectroscopic approach of Terahertz Time-Domain Spectroscopy (THz-TDS) and THz Raman Spectroscopy (THz-RS). Two different isomeric molecular systems have also been investigated to assess both the selectivity and specificity of low energy modes in their identification and spectral correlation in terms of molecular interactions. This information of low frequency modes can be utilized readily by pharmaceutical and agri-food industries, chemical engineering and crystal growth communities in identification, detection, quality control and industrial waste management.

Critical spectroscopic considerations towards reliable detection of material using terahertz time-domain spectroscopy.

Terahertz (THz) time-domain spectroscopic (TDS) and imaging techniques have been recognized as important tools in recent times for non-contact and non-destructive evaluation of materials, such as, food, pharmaceuticals, and other composite materials of interest. The application of the THz-TDS technique in both material identification and quantification, however, involves the analyses of extremely complex response of the constituents of these composite materials. For a spectroscopist, therefore, it is essential to consider certain critical spectroscopic parameters while acquiring the spectroscopic data using THz-TDS. In this work, using sorbic acid, a widely used preservative in processed food as the typical sample for the spectroscopic measurements, we have systematically investigated the impact of all these critical factors on the spectroscopic identification, quantification, and repeatability of the same. We observed that any sample inhomogeneity or clusters formed inside the composite pellet of the sorbic acid mixed with Teflon during pellet preparation can lead to false spectral responses, depending on the choice of spectroscopic probing point on the sample and number of spectroscopic averages. Furthermore, we analyzed the THz-TDS acquisition in frequency-domain and noted the effect of pellet thickness and sample concentration on the resultant frequency bandwidth and absorption features. Besides THz spectroscopists, a clear understanding of these aspects addressed in this present work, will also assist material engineers in selecting optimum concentration and weight towards formulating advanced composites.

Terahertz interferometric and synthetic aperture imaging.

The stand-off imaging properties of a terahertz (THz) interferometric array are examined. For this application, the imaged object is in the near-field region limit of the imaging array. In this region, spherical and circular array architectures can compensate for near-field distortions and increase the field of view and depth of focus. Imaging of THz point sources is emphasized to demonstrate the imaging method and to compare theoretical predictions to experimental performance.