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Keywords = terahertz time-domain spectroscopy (THz-TDS)

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18 pages, 4440 KB  
Article
Quantitative Prediction of Coal–Gangue Content Using Terahertz Time-Domain Spectroscopy and Physics-Informed Machine Learning
by Zeping Liu, Lipeng Hu, Jianfei Xu, Yadong Yang, Sitong Li, Zhou Xu, Longhai Liu, Jiabao Li, Houli Liu and Dongdong Ye
Materials 2026, 19(17), 3776; https://doi.org/10.3390/ma19173776 - 4 Sep 2026
Abstract
Quantitative determination of gangue content is important for efficient coal use and intelligent coal–gangue separation. We combine transmission terahertz time-domain spectroscopy (THz-TDS), multidomain feature fusion, and machine learning to predict gangue mass fraction in coal–gangue mixtures. Time- and frequency-domain signals, refractive index, absorption [...] Read more.
Quantitative determination of gangue content is important for efficient coal use and intelligent coal–gangue separation. We combine transmission terahertz time-domain spectroscopy (THz-TDS), multidomain feature fusion, and machine learning to predict gangue mass fraction in coal–gangue mixtures. Time- and frequency-domain signals, refractive index, absorption and extinction coefficients, and complex permittivity were extracted from samples with different gangue contents. Five-fold cross-validation was used to compare random forest, support vector regression, Gaussian process regression, an artificial neural network, and an Effective Medium Theory-constrained Physics-Informed Neural Network (EMT-PINN). EMT-PINN achieved the best performance, with a coefficient of determination (R2) of 0.81 ± 0.15, a mean absolute error (MAE) 3.17 ± 0.59%, and a root mean square error (RMSE) of 5.79 ± 0.21%, compared with R2 values of 0.72 ± 0.08, 0.61 ± 0.21, 0.74 ± 0.11, and 0.64 ± 0.18 for RF, SVR, GPR, and ANN, respectively. These results demonstrate the potential of physics-informed THz spectroscopy for rapid and physically interpretable quantitative characterization of coal–gangue mixtures. Full article
24 pages, 4667 KB  
Review
Terahertz Time-Domain Spectroscopy as a Defect Fingerprinting Tool for Halide Perovskite Solar Cells: Toward a Universal Framework
by Inhee Maeng, Young Mi Lee, Jinwoo Park, Seung Jae Oh and Min-Cherl Jung
Nanomaterials 2026, 16(17), 1072; https://doi.org/10.3390/nano16171072 - 28 Aug 2026
Viewed by 347
Abstract
Organic–inorganic hybrid perovskites (OHPs) deliver certified single-junction power conversion efficiencies (PCEs) of up to 27.3% and National Laboratory of the Rockies (NLR)-certified perovskite–silicon tandem values of 34.85%, yet a substantial gap with the Shockley–Queisser (S–Q) limit persists. Grain-boundary (GB) defects are one principal [...] Read more.
Organic–inorganic hybrid perovskites (OHPs) deliver certified single-junction power conversion efficiencies (PCEs) of up to 27.3% and National Laboratory of the Rockies (NLR)-certified perovskite–silicon tandem values of 34.85%, yet a substantial gap with the Shockley–Queisser (S–Q) limit persists. Grain-boundary (GB) defects are one principal contributor to this gap, driving non-radiative recombination, ion migration, and degradation alongside bulk, interfacial, contact-related, phase-related, and environmental loss channels. Rational passivation demands a non-contact tool capable of identifying and quantifying specific defect species in device-relevant thin films, a capability that conventional probes deliver only in part. This overview assesses the extent to which terahertz time-domain spectroscopy (THz-TDS, 0.2–2.5 THz) fulfills this role. Across five OHP compositions—MAPbI3, MAPbBr3, FAPbI3, and FAPb(Br,I)3 fabricated by sequential vacuum evaporation (SVE), together with solution-processed γ-CsPbI3—the THz spectral window captures both intrinsic phonon modes and GB-localized molecular defect vibrations, enabling species-resolved characterization at room temperature. Notably, the oscillator strength of the SVE-specific 1.58 THz absorption in MAPbI3 scales linearly with XPS-quantified CH3NH2 defect concentration, establishing a calibrated, contact-free proxy for defect concentration rather than an absolute defect count; the observable is the defect-induced perturbation of the Pb–X lattice, not the defect population itself. Building on these findings, we propose a three-pillar framework for THz-guided defect engineering: (I) quantitative defect measurement via oscillator-strength analysis, (II) material-specific fingerprint identification from a systematically constructed THz library, and (III) fingerprint-guided defect elimination with real-time feedback—together defining a closed-loop quality-control cycle that connects spectroscopic diagnosis to passivation strategy and, ultimately, to enhanced solar cell efficiency. Throughout, we distinguish capabilities demonstrated to date from extensions that remain proposals, and we define the measurement requirements needed before the framework can be transferred to inline manufacturing control. Full article
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26 pages, 2923 KB  
Review
Applications of THz Technology in Materials Characterization, Sensing, Communication, and Biomedical Fields
by Kunal Kumar and Abdullah Eroglu
Electronics 2026, 15(15), 3454; https://doi.org/10.3390/electronics15153454 - 4 Aug 2026
Viewed by 401
Abstract
Terahertz (THz) technology has emerged as a versatile platform enabling advancements across materials characterization, sensing, wireless communication, and biomedical diagnostics. This review provides a unified perspective on these application domains by highlighting the central role of terahertz time-domain spectroscopy (THz-TDS) as a fundamental [...] Read more.
Terahertz (THz) technology has emerged as a versatile platform enabling advancements across materials characterization, sensing, wireless communication, and biomedical diagnostics. This review provides a unified perspective on these application domains by highlighting the central role of terahertz time-domain spectroscopy (THz-TDS) as a fundamental tool for probing material electrodynamics. THz-TDS enables simultaneous measurement of amplitude and phase of the electric field, allowing contact-free direct extraction of complex permittivity, conductivity and other dielectric properties. Building on this capability, the review connects material-level properties to device and system-level functionalities, including metamaterial-based sensors, graphene-enabled reconfigurable intelligent surfaces (RISs), and beam-steering architectures relevant to 6G and beyond communication systems. Furthermore, the potential of THz techniques in biomedical applications is discussed in detail, particularly for non-invasive tumor detection through dielectric contrast mapping and imaging-based reconstruction methods. By integrating developments across these domains, this review presents THz-TDS as a unifying framework that links materials physics to emerging technologies in sensing, communication, and healthcare, offering insights into future directions for THz research and applications. The principal contribution of this review is to present a cross-domain framework that relates THz field measurements and extracted material electrodynamics to sensing, reconfigurable wavefront control, communication technologies, and biomaterials characterization. Full article
(This article belongs to the Special Issue Terahertz Communication Networks for 6G and Beyond)
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15 pages, 4549 KB  
Article
A Comparative Study of Machine Learning Algorithms for Measuring Thin-Film Thickness Using Terahertz Time-Domain Waves Simulated by the Finite Difference Time Domain Method
by Pingan Liu, Xiangjun Li, Yibing Liu and Liguo Zhu
Coatings 2026, 16(8), 931; https://doi.org/10.3390/coatings16080931 - 4 Aug 2026
Viewed by 324
Abstract
Terahertz (THz) waves offer unique advantages, including non-contact operation, high penetration capability, and high resolution, making them particularly well-suited for the non-destructive thickness measurement of film-structured materials. In reflective terahertz time-domain spectroscopy (THz-TDS), thickness measurement approaches are generally classified into three categories: optimization-based [...] Read more.
Terahertz (THz) waves offer unique advantages, including non-contact operation, high penetration capability, and high resolution, making them particularly well-suited for the non-destructive thickness measurement of film-structured materials. In reflective terahertz time-domain spectroscopy (THz-TDS), thickness measurement approaches are generally classified into three categories: optimization-based methods that rely on theoretical models, time-of-flight (ToF), and machine learning. Model-based optimization techniques require precise knowledge of the optical parameters and structural configuration of each layer; however, they often suffer from slow convergence and are prone to becoming trapped in local optima. In contrast, ToF-based methods determine thickness by calculating the time delay between echo pulses reflected from different interfaces, yet their applicability is limited when the film thickness is extremely small. Machine learning, especially deep learning, enables the establishment of a direct, data-driven mapping between THz waveforms (or their extracted features) and the target thickness. Such approaches offer rapid inference, strong robustness to noise, and good adaptability to thin or structurally complex films, although their accuracy remains dependent on the quality of training data and the generalization capability of the model. In this study, high-fidelity THz waveform data generated via finite-difference time-domain (FDTD) simulations are utilized to conduct a comparative investigation into the film thickness prediction performance of several representative machine learning algorithms, including Back Propagation (BP) neural networks, Support Vector Machines (SVM), Random Forests (RF), Extreme Learning Machines (ELM), K-Nearest Neighbors (KNN), and Partial Least Squares (PLS) regression. The results indicate that, in terms of prediction error, the overall ranking of algorithmic performance from best to worst is: PLS > RF > SVM > BP > ELM > KNN. These findings provide valuable guidance for the future application of machine learning-assisted THz-TDS in precise film thickness measurement. Full article
(This article belongs to the Section Thin Films)
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9 pages, 1317 KB  
Communication
Reference-Free Terahertz Time-Domain Spectroscopy for Direct Measurement of Birefringence and Linear Dichroism
by Maoto Suzuki, Tetsuo Sasaki and Saroj R. Tripathi
Photonics 2026, 13(7), 681; https://doi.org/10.3390/photonics13070681 - 17 Jul 2026
Viewed by 480
Abstract
Terahertz time-domain spectroscopy (THz-TDS) is a widely used technique for characterizing a broad range of materials in the terahertz frequency region. Conventional THz-TDS requires both reference and sample signals to extract optical parameters such as refractive index and absorption coefficient. Determining optical anisotropy, [...] Read more.
Terahertz time-domain spectroscopy (THz-TDS) is a widely used technique for characterizing a broad range of materials in the terahertz frequency region. Conventional THz-TDS requires both reference and sample signals to extract optical parameters such as refractive index and absorption coefficient. Determining optical anisotropy, specifically birefringence and linear dichroism, typically requires separate measurements of the optical parameters of the sample parallel and perpendicular to the terahertz electric field. This process increases measurement time and depends heavily on a stable reference scan. In this work, we present a simple and accurate method to directly obtain birefringence and linear dichroism without the need for a reference measurement. The proposed approach extracts anisotropic parameters solely from the sample signals by analyzing the differential phase delay and amplitude attenuation between orthogonally polarized terahertz electric field components. We validate this method experimentally using optically anisotropic materials such as TiO2 and bamboo samples and confirm that the results agree closely with those from conventional reference-based THz-TDS. This technique offers a practical route to measure the optical anisotropy of materials, particularly in situations where acquiring a reference signal is challenging. Full article
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20 pages, 4931 KB  
Article
Terahertz Time-Domain Spectroscopy for Non-Contact Porosity Estimation and Hydration Assessment of Hardened Cement Paste
by Lidan Tian, Zhiguo Wang, Ya Chen, Wentao Zhang, Linhao Wang and Xiangyu Li
Materials 2026, 19(13), 2726; https://doi.org/10.3390/ma19132726 - 25 Jun 2026
Viewed by 386
Abstract
This study presents a systematic terahertz time-domain spectroscopy (THz-TDS) investigation of hardened cement paste, framed as a complex-optical measurement in which the real and imaginary parts of the response probe distinct microstructural attributes. Transmission-mode measurements were made on pastes with water-to-cement (w/c) ratios [...] Read more.
This study presents a systematic terahertz time-domain spectroscopy (THz-TDS) investigation of hardened cement paste, framed as a complex-optical measurement in which the real and imaginary parts of the response probe distinct microstructural attributes. Transmission-mode measurements were made on pastes with water-to-cement (w/c) ratios of 0.3, 0.4, and 0.5 at curing ages of 7, 14, 28, and 56 days. The effective refractive index, obtained from the time-domain pulse delay (7, 28, and 56 days, paired with mercury intrusion porosimetry), correlates strongly and linearly with porosity over nine porosity-paired conditions spanning 15.1–30.4% (pooled R2 = 0.94, p < 0.001). In a quasi-static effective-medium framework—where the pores a re far smaller than the THz wavelength—this reflects the dependence of the effective permittivity on the solid volume fraction: the Bruggeman model outperforms the Maxwell–Garnett model, and all data fall within the Wiener bounds, lying close to the upper bound, indicating a continuously connected solid matrix with isolated pores. Cross-validated porosity estimation is reliable to within about ±2 percentage points (refractive-index uncertainty ±0.02–0.04). The absorption follows a power law (β ≈ 1.0–1.3) characteristic of disorder-activated vibrational absorption, in which the loss of long-range order in the amorphous C–S–H relaxes the crystalline selection rules and couples the THz field to the full vibrational density of states. The refractive index (structure-sensitive, governed by volume fraction) and the absorption (material-sensitive, governed by solid disorder; estimated loss tangent of order 0.1) thus form two complementary channels. Combining the THz-derived porosity with the Powers hydration model gives a degree of hydration consistent with literature ranges—an indirect comparison rather than direct validation. These results establish THz-TDS as a non-contact, non-ionizing technique for rapid porosity estimation and hydration assessment of cementitious materials. Full article
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13 pages, 3370 KB  
Article
THz ATR-TDS Spectroscopy of Acetone–Water Mixtures: Hydrogen Bonding to Dipole–Dipole Dynamics
by Zahra Mazaheri, Anagha Ramankandath, Junaid Yaseen, Can Koral, Gian Paolo Papari and Antonello Andreone
Int. J. Mol. Sci. 2026, 27(12), 5188; https://doi.org/10.3390/ijms27125188 - 8 Jun 2026
Viewed by 421
Abstract
Attenuated total reflection time-domain spectroscopy (ATR-TDS) in the terahertz regime was employed to investigate the dielectric response of water–acetone mixtures over the full molar concentration range. The ATR configuration enabled stable measurements in a controlled and nearly closed environment, minimizing acetone evaporation and [...] Read more.
Attenuated total reflection time-domain spectroscopy (ATR-TDS) in the terahertz regime was employed to investigate the dielectric response of water–acetone mixtures over the full molar concentration range. The ATR configuration enabled stable measurements in a controlled and nearly closed environment, minimizing acetone evaporation and allowing reliable characterization of this highly volatile binary system. The complex dielectric function, retrieved in the 0.4–1.6 THz range, was analyzed by means of a double Cole–Cole model, which provided a more consistent description of the mixtures than a simple Debye-based approach. A strongly nonlinear dependence on composition was observed, with the highest sensitivity in the water-rich region, where even small amounts of acetone produced a marked change in both the real and imaginary parts of the dielectric function. The extracted parameters indicate that acetone primarily suppresses the slow, cooperative relaxation channel associated with the hydrogen-bond network of water, whereas the faster channel remains comparatively less affected, consistent with its more local intermolecular origin. The evolution of the Kirkwood–Fröhlich correlation factors and of the broadening parameters further supports a progressive transition from a highly correlated hydrogen-bonded liquid to a structurally heterogeneous and weakly cooperative dipolar environment. These results demonstrate that THz ATR-TDS is a sensitive tool for probing intermolecular reorganization in aqueous binary mixtures, providing a physically grounded framework for the detection of acetone and other volatile hydrogen-bond-active species in water-based systems. Full article
(This article belongs to the Section Physical Chemistry and Chemical Physics)
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14 pages, 3833 KB  
Article
Terahertz Dielectric Characterization and Hybrid Debye–Lorentz Modeling of Silicone Rubber Composites for Composite Insulators
by Tengyi Zhang, Li Cheng, Shuo Zhang, Bo Tao and Qingyue Tan
Polymers 2026, 18(12), 1427; https://doi.org/10.3390/polym18121427 - 8 Jun 2026
Viewed by 546
Abstract
High-temperature vulcanized (HTV) silicone rubber serves as the core material for composite insulators, and its high-frequency dielectric properties directly dictate its macroscopic insulation performance. However, traditional electrical detection methods encounter a “high-frequency blind zone” above the gigahertz (GHz) range due to limited precision [...] Read more.
High-temperature vulcanized (HTV) silicone rubber serves as the core material for composite insulators, and its high-frequency dielectric properties directly dictate its macroscopic insulation performance. However, traditional electrical detection methods encounter a “high-frequency blind zone” above the gigahertz (GHz) range due to limited precision and ambiguous physical mechanisms. In this study, terahertz time-domain spectroscopy (THz-TDS) was employed to characterize the complex permittivity spectra of silicone rubber specimens, incorporated with varying ratios of alumina trihydrate (ATH) and silica (SiO2) fillers, across the 0.1–3.0 THz frequency range. Experimental results reveal that the terahertz dielectric characteristics of silicone rubber exhibit a pronounced filler dependency: as the ATH content increases from 95 phr to 185 phr, the real part of the permittivity at 1 THz increases by 32%. Notably, all specimens manifest a sharp dielectric transition near 1.2 THz, characterized by distinct dual absorption peaks in the imaginary permittivity spectra. To characterize this non-linear transition, a hybrid Debye–Lorentz model is innovatively introduced. This approach overcomes the inherent limitations of traditional double Debye models, which are restricted to relaxation processes and fail to account for high-frequency resonance. Fitting results and physical analysis demonstrate that the response at 1.2 THz is primarily attributed to the bending vibrations of Si-O-Si bonds in the polymer backbone, alongside the collective vibration modes of Al-O bonds and the hydrogen-bonded network within the fillers. The hybrid model successfully decouples three distinct polarization mechanisms: conduction loss (<0.5 THz), dipole relaxation (0.5–1.0 THz), and lattice resonance (>1.0 THz). This work provides a robust characterization framework for the quantitative evaluation of the high-frequency dielectric response and microstructural integrity of composite insulators. Full article
(This article belongs to the Section Polymer Physics and Theory)
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11 pages, 1815 KB  
Article
Raman Inactive Phonon–Polariton Dispersion of Quantum Paraelectric KTaO3 Proved by Broadband Terahertz Time-Domain Spectroscopy and FTIR
by Tatsuya Mori, Miroslaw Maczka and Seiji Kojima
Solids 2026, 7(3), 29; https://doi.org/10.3390/solids7030029 - 1 Jun 2026
Viewed by 617
Abstract
KTaO3 (KTO) is a quantum paraelectric perovskite oxide which belongs to the cubic space group Pm3¯m in a large temperature range. Polar optical modes with a T1u symmetry of KTO are infrared-active and Raman-inactive according to the centrosymmetric [...] Read more.
KTaO3 (KTO) is a quantum paraelectric perovskite oxide which belongs to the cubic space group Pm3¯m in a large temperature range. Polar optical modes with a T1u symmetry of KTO are infrared-active and Raman-inactive according to the centrosymmetric exclusion principle of the selection rule. In general, the soft modes responsible for ferroelectric instability are infrared-active and Raman-inactive in the paraelectric phase. Therefore, there are still not enough studies on Raman-inactive soft modes and related phonon polaritons. In the present study, Raman-inactive polar modes and related polaritons of KTO crystals are studied by Terahertz Time-Domain spectroscopy (THz-TDS) and FTIR. The real and imaginary parts of a dielectric constant along the [100] axis are uniquely determined by transmission and reflection THz-TDS without any fitting in the low-frequency range between 6 and 225 cm−1, which covers the two lowest-frequency polar modes. The reflectivity is determined by reflection FTIR in the range between 50 and 1200 cm−1, and the complex dielectric constant is also estimated by the fitting in the range between 6 and 1200 cm−1. The phonon–polariton dispersion relations of the real and imaginary parts of the polariton wavevector are also studied in the range between 6 and 1200 cm−1. The crossover from photon-like to phonon-like polaritons and related polariton decay are observed, while no anomaly related to polariton scattering and coupling to other elementary excitations is observed in the polariton dispersion. Full article
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23 pages, 28008 KB  
Article
Quantitative Measurement and Analytical Modeling of Terahertz Wave Transmission in Natural Rock Materials Under Drying–Wetting Cycles
by Yinghu Li, Qiangling Yao, Kaixuan Liu, Minkang Han, Qiang Xu and Ze Xia
Materials 2026, 19(10), 2085; https://doi.org/10.3390/ma19102085 - 15 May 2026
Viewed by 518
Abstract
The functional performance and structural integrity of natural rock materials under fluctuating environmental stressors are pivotal for their advanced applications. As a non-ionizing and radiation-free technology, terahertz (THz) spectroscopy offers a safe and promising alternative for non-destructive testing (NDT), uniquely capable of being [...] Read more.
The functional performance and structural integrity of natural rock materials under fluctuating environmental stressors are pivotal for their advanced applications. As a non-ionizing and radiation-free technology, terahertz (THz) spectroscopy offers a safe and promising alternative for non-destructive testing (NDT), uniquely capable of being deployed in open and unshielded environments. However, limited penetration depth, exacerbated by both the dense geological matrix and the extreme sensitivity of THz waves to moisture states, has long hindered its widespread application in rock characterization. This study establishes a quantitative Terahertz Time-Domain Spectroscopy (THz-TDS) framework to characterize four lithologies under drying–wetting cycles. Exponential signal attenuation across thicknesses was quantified based on the Beer–Lambert law, with attenuation coefficients ranging from 0.15 to 0.74 per millimeter. Planar transmission imaging successfully visualizes lithologic and moisture-dependent heterogeneity: limestone exhibits a dense, homogeneous structure with stable amplitude distribution; sandstone and purple sandstone show parallel statistical trends, reflecting uniform pore networks; and granite demonstrates the most pronounced imaging contrast under varying moisture states, driven by complex grain-boundary scattering. The findings reveal that THz transmission is dictated by the synergistic effects of mineral compositions and pore structures: scattering at grain boundaries and fractures leads to significant energy dissipation, whereas clay-rich lithologies exhibit the highest sensitivity to moisture variations due to water adsorption and interfacial polarization effects. As an exploration of THz technology in the non-destructive evaluation of rock materials, these findings establish an analytical framework for the quantitative assessment of microstructure evolution. Full article
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17 pages, 7760 KB  
Article
Terahertz Time-Domain Spectroscopy in Molybdenum Exploration: A Case Study of the Dengshang Deposit, North China Craton
by Xiao-Xia Li, Shan-Shan Li, Murat Tamer, Zhuo-Er Teng, Qun-Feng Miao, Jia-Hui Zhou, Cheng-Xun Li, Ze-Hai Peng, Hao-Chong Huang, Zhi-Yuan Zheng and Kun-Feng Qiu
Geosciences 2026, 16(5), 187; https://doi.org/10.3390/geosciences16050187 - 7 May 2026
Viewed by 503
Abstract
Porphyry-type deposits are characterized by well-developed alteration zoning, among which potassic alteration is closely associated with mineralization and represents a key target for prospecting and exploration. The Dengshang molybdenum deposit is a porphyry-type deposit within the Yanliao molybdenum metallogenic belt. Characterized by deep [...] Read more.
Porphyry-type deposits are characterized by well-developed alteration zoning, among which potassic alteration is closely associated with mineralization and represents a key target for prospecting and exploration. The Dengshang molybdenum deposit is a porphyry-type deposit within the Yanliao molybdenum metallogenic belt. Characterized by deep burial and unclear alteration zoning, it presents challenges for prospecting and exploration. This study integrates field surveys, petrographic analysis, and terahertz time-domain spectroscopy (THz-TDS) to characterize the altered wall rocks and molybdenite ores, aiming to support deep prospecting. The main findings reveal a clear spatial gradient from potassic to propylitic alteration zones within and around the rhyolite porphyry intrusion. THz-TDS reveals that the THz spectral characteristics of potassic-altered wall rocks are closely related to the structure of minerals and the intensity of hydrothermal alteration. Propylitically altered wall rocks exhibit distinctive spectral signatures in the terahertz band. For molybdenite ores, the molybdenite content shows a negative correlation with THz amplitude and a positive correlation with both the absorption coefficient and refractive index. This study proposes that the lower refractive index and absorption coefficient of potassic wall rocks, coupled with the higher values in ores, reflect the spatial position of the ore body. Additionally, the characteristic THz spectral curve of propylitically altered rocks can aid in delineating ore body boundaries. These findings hold practical guiding significance for prospecting and exploration. Full article
(This article belongs to the Special Issue Isotope Geochemistry: New Techniques and Applications)
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15 pages, 2774 KB  
Article
High-Sensitivity Terahertz Time-Domain Spectroscopic Characterization of the Thermal Evolution of Hydrated Copper Sulfate
by Yuqiu Jiao, Xinyu Li, Yuqi Zhang, Qingying Xie and Yuhong Xia
Molecules 2026, 31(8), 1342; https://doi.org/10.3390/molecules31081342 - 19 Apr 2026
Viewed by 693
Abstract
To elucidate the influence of water on terahertz (THz) spectral responses, terahertz time-domain spectroscopy (THz-TDS) was employed to monitor the thermal decomposition of copper(II) sulfate pentahydrate in this study. Continuous dehydration of the hydrate induces pronounced variations in the THz signal. At the [...] Read more.
To elucidate the influence of water on terahertz (THz) spectral responses, terahertz time-domain spectroscopy (THz-TDS) was employed to monitor the thermal decomposition of copper(II) sulfate pentahydrate in this study. Continuous dehydration of the hydrate induces pronounced variations in the THz signal. At the initial stage of thermal decomposition, these changes primarily originate from the evolving state and amount of water confined within the CuSO4·5H2O lattice. After detaching from the crystalline framework, the released water molecules do not evaporate immediately; instead, they transiently reside near the copper sulfate as free water. When the temperature reaches approximately 60 °C, a dynamic equilibrium is established between crystalline water and free water. The THz spectral data reveal that the sample exhibits its strongest THz absorption at this temperature. Consequently, the THz signal during decomposition displays a characteristic trend: an initial decrease followed by an enhancement. These findings demonstrate that THz-TDS represents a promising approach for probing the state and content of water, thereby contributing to the development of a powerful analytical tool for fundamental studies in mineralogy. Full article
(This article belongs to the Special Issue 30th Anniversary of Molecules—Recent Advances in Physical Chemistry)
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26 pages, 13111 KB  
Review
Advancing Terahertz Biochemical Sensing: From Spectral Fingerprinting to Intelligent Detection
by Haitao Zhang, Zijie Dai, Yunxia Ye and Xudong Ren
Photonics 2026, 13(4), 379; https://doi.org/10.3390/photonics13040379 - 16 Apr 2026
Viewed by 1951
Abstract
Biochemical detection is fundamental to various scientific disciplines, yet conventional methods still face inherent bottlenecks in achieving rapid, ultrasensitive, and simultaneous multi-target analysis. Terahertz (THz) waves, characterized by their unique spectral fingerprinting capabilities and non-destructive properties, have emerged as a compelling platform for [...] Read more.
Biochemical detection is fundamental to various scientific disciplines, yet conventional methods still face inherent bottlenecks in achieving rapid, ultrasensitive, and simultaneous multi-target analysis. Terahertz (THz) waves, characterized by their unique spectral fingerprinting capabilities and non-destructive properties, have emerged as a compelling platform for advanced biochemical sensing. This review outlines the evolution of THz biochemical sensing over the past two decades, tracing its progression from passive identification toward intelligent perception. We structure this technological trajectory around four core themes: sensitivity enhancement, specific recognition, multi-target visualization, and system intelligence. We first evaluate the fundamental limitations of direct detection techniques, such as THz time-domain spectroscopy (THz-TDS). Building on this, we examine how metamaterial-assisted architectures utilize high-quality-factor resonances to achieve trace-level detection, pushing the limits of detection (LOD) down to the ng/mL or even pg/mL scale, and how surface chemical functionalization provides a molecular lock mechanism for selective targeting in complex samples. Furthermore, we highlight the paradigm shift from single-point spectral measurements to spatially resolved multi-target imaging using pixelated metasurfaces. Finally, the review addresses emerging directions, including dynamically tunable intelligent metasurfaces, multimodal on-chip integration platforms, and the growing integration of artificial intelligence (AI) in inverse design and data interpretation, which achieves classification accuracies exceeding 95% even in complex matrices. By synthesizing these developments, this review provides a comprehensive perspective on the future trajectory of THz sensing technologies. Full article
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15 pages, 2527 KB  
Article
A Refined Methodological Approach for Terahertz Spectroscopy of Liquid Biosamples
by Deborah Amos Adigun, Mikhail Gorbun, Aadya Menon, Janna Pennanen, Polina Kuzhir and Georgy Fedorov
Photonics 2026, 13(4), 373; https://doi.org/10.3390/photonics13040373 - 14 Apr 2026
Viewed by 628
Abstract
Terahertz time-domain spectroscopy (THz-TDS) has emerged as a powerful tool for probing hydrated materials and biological tissues, where water dynamics dominate the dielectric response. This study focuses on improving the methodology of THz-TDS by replacing conventional cuvettes, which introduce unwanted absorption, reflections, and [...] Read more.
Terahertz time-domain spectroscopy (THz-TDS) has emerged as a powerful tool for probing hydrated materials and biological tissues, where water dynamics dominate the dielectric response. This study focuses on improving the methodology of THz-TDS by replacing conventional cuvettes, which introduce unwanted absorption, reflections, and liquid bubbles that must be accounted for during measurement interpretation, with nitrocellulose membranes of various pore sizes. The membranes were hydrated with deionized water and sealed with food-grade cling film, and their transmission properties were measured using THz-TDS. To interpret the measurements, transfer matrix method simulations were performed using the optical constants of water reported by some experimentalists, allowing verification of our data. The findings for deionized water highlight the reliability of the methodology. Our results demonstrate that nitrocellulose membranes provide stable and reproducible transmission measurements in good agreement with theoretical reference models, supported by weight retention studies and reproducibility tests conducted in spatial, temporal, and random measurement conditions. These improvements contribute to the development of more robust THz-TDS approaches for hydrated biological materials and suggest future applications in non-invasive tissue hydration monitoring and biomedical diagnostics. Full article
(This article belongs to the Section Biophotonics and Biomedical Optics)
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21 pages, 3501 KB  
Article
Subsurface Fracture Mapping in Adhesive Interfaces Using Terahertz Spectroscopy
by Mahavir Singh, Sushrut Karmarkar, Marco Herbsommer, Seongmin Yoon and Vikas Tomar
Materials 2026, 19(2), 388; https://doi.org/10.3390/ma19020388 - 18 Jan 2026
Viewed by 855
Abstract
Adhesive fracture in layered structures is governed by subsurface crack evolution that cannot be accessed using surface-based diagnostics. Methods such as digital image correlation and optical spectroscopy measure surface deformation but implicitly assume a straight and uniform crack front, an assumption that becomes [...] Read more.
Adhesive fracture in layered structures is governed by subsurface crack evolution that cannot be accessed using surface-based diagnostics. Methods such as digital image correlation and optical spectroscopy measure surface deformation but implicitly assume a straight and uniform crack front, an assumption that becomes invalid for interfacial fracture with wide crack openings and asymmetric propagation. In this work, terahertz time-domain spectroscopy (THz-TDS) is combined with double-cantilever beam testing to directly map subsurface crack-front geometry in opaque adhesive joints. A strontium titanate-doped epoxy is used to enhance dielectric contrast. Multilayer refractive index extraction, pulse deconvolution, and diffusion-based image enhancement are employed to separate overlapping terahertz echoes and reconstruct two-dimensional delay maps of interfacial separation. The measured crack geometry is coupled with load–displacement data and augmented beam theory to compute spatially averaged stresses and energy release rates. The measurements resolve crack openings down to approximately 100 μm and reveal pronounced width-wise non-uniform crack advance and crack-front curvature during stable growth. These observations demonstrate that surface-based crack-length measurements can either underpredict or overpredict fracture toughness depending on the measurement location. Fracture toughness values derived from width-averaged subsurface crack fronts agree with J-integral estimates obtained from surface digital image correlation. Signal-to-noise limitations near the crack tip define the primary resolution limit. The results establish THz-TDS as a quantitative tool for subsurface fracture mechanics and provide a framework for physically representative toughness measurements in layered and bonded structures. Full article
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