We present density functional theory calculations to study the interplay between magnetic and structural properties in Ni-Co-Mn-Sn. The relative stability of austenite (cubic) and martensite (tetragonal) phases depends critically on the magnetic interactions between Mn atoms. While the standard generalized gradient approximation (GGA) stabilizes the latter phase, correlation effects beyond GGA tend to suppress this effect. Mn atoms treated as magnetic impurities can explain our results, where a delicate balance between magnetic interactions mediated by Ni d and Sn p orbitals determines the equilibrium structure of the crystal. Finally, we discuss the role of Co doping in stabilizing ferromagnetic austenite phases.

In this paper, we studied the temperature dependency effect of thermal coefficient of resistance (TCR) in amorphous silicon (a-Si) on the properties of uncooled microbolometer with a-Si as a resistance layer by simulation. The temperature of the microbolometer rises during the operation mainly due to the heat generated by Joule heating as well as IR radiation. Generally, the TCR of a-Si is treated as a constant for the simplicity but the absolute value of TCR has been reported to decrease as the temperature increases. Therefore, to improve the device characteristics, the effect of temperature dependency of TCR in a-Si should be considered carefully in the range of the operating temperature. The responsivities of microbolometer are simulated according to the width of the resistance layer (W) with TCR as a function of temperature, which shows that the optimal W condition is affected by the TCR value changed by the temperature.

Thermoelectric technology has key benefits and strengths in many terrestrial energy recovery applications. Thermoelectric system cost is a key factor governing final decisions on the use of thermoelectric energy recovery systems in all terrestrial applications; thus cost being just as important as power density or efficiency for the adoption of waste energy recovery (WER) thermoelectric generators (TEG). New integrated cost analysis / thermoelectric analysis approaches have now shown key relationships and interdependencies between overall TEG system costs, including TE material costs, manufacturing costs, and specifically heat exchanger costs; and the TE performance design metrics such as TE material properties, TE device design parameters, heat exchanger performance metrics such as hot-side and cold-side conductances and UA values, and hot side heat flux in achieving optimal TEG WER designs. These new approaches have led to a new thermoelectric system economics paradigm that strongly influences TEG cost and performance decisions. While prior work provided foundations for the latest cost scaling analysis / TE performance analysis, this new work offers new insights and understandings and provides the basis for new thermoelectric system economics. Optimum TEG system cost conditions can now be tied directly to the TE materials, TEG design parameters, and heat exchanger design parameters through critical non-dimensional analysis. The non-dimensional analysis and metrics show the TEG system cost and performance interdependencies and intercouplings in one unifying and cohesive relationship. Prior work by T.J. Hendricks, S.K. Yee, and S. LeBlanc, J of Electronic Mater, 45, (3), 1751-1761, 2015 has shown that the system design that minimizes cost (e.g., the G [$/W] value) can be close to designs that maximize power, but these design regimes are not necessarily aligned with high system conversion efficiency or high specific power. Key sensitivities and interrelationships between critical cost metrics and critical TE performance and design metrics in the new thermoelectric system economics paradigm are explored. Quantitative data showing these sensitivities and their implications on TEG system design in terrestrial WER applications are presented. Critical non-dimensional parameter mapping has shown where heat exchanger cost- dominated conditions, TE material or manufacturing cost-dominated conditions, and combinations of cost conditions control and drive the overall TEG cost and performance. This new cost-performance paradigm shows the required pathways and challenges to achieving TEG system costs of $1 -$3/Welec.

As the global energy and environmental preservation needs continue to grow, the demand for renewable and clean energy conversion materials and devices continues to rise as well. Thermoelectric (TE) materials and devices can convert waste heat into electricity and therefore it can be a potential renewable and clean energy source. Organic and polymeric materials typically exhibit low electrical conductivities, high Seebeck coefficients, and orders of magnitude lower thermal conductivities as compared to their inorganic counterparts. However, the electrical conductivities of organic/polymeric materials are tunable via doping or molecular engineering. In this study, a series of carefully doped P3HT composites are systematically evaluated for heat as well as light modulated devices. Along with a high absorption coefficient, when the polymer film thickness is less than the penetration depth of the incoming photons, the photo effects are significant and could be very useful for light modulations of thermoelectric functions. With further systematic studies and a better understanding of the mechanisms behind the photo-Seebeck effect, the development of potential high-efficiency multi-function materials and devices appears feasible.

We have developed new flexible dye-sensitized solar cells (DSSCs) comprising organic dye (JH-1), cobalt redox electrolyte and hierarchically structured TiO2 (HS-TiO2) photoelectrode prepared using an electrostatic spray method. The performance of JH-1 sensitized flexible DSSC with a cobalt redox electrolyte was compared with those of N719-based DSSC and DSSC with I-/ I3- redox electrolyte. As a result, JH-1 sensitized flexible DSSC with [Co(Ⅲ/Ⅱ)(bpy-pz)3](PF6)3/2 redox system exhibited a high photocurrent density of 9.17 mA cm-2, an open circuit voltage of 0.953 V, a fill factor of 0.70, and a power conversion efficiency of 6.12% under 1 sun illumination (100 mW cm-2). The incident photon-to-current conversion efficiency was measured to explain the photocurrent generation difference by different dyes and electrolytes. The electron recombination lifetime of cells was measured by intensity-modulated photovoltage spectroscopy. Mass transport in DSSCs employing cobalt redox electrolytes was also investigated by the photocurrent transient measurements and electrochemical impedance spectroscopy (EIS) analysis.

Single-leg (p × n)-type transverse thermoelectrics (TTE) are reviewed as an alternative to conventional or “longitudinal” double-leg thermoelectrics for applications at room temperature and below. As the name suggests, this unique behavior of (p × n)-type transverse thermoelectrics results from choosing ambipolar anisotropic materials that have a Seebeck tensor with orthogonal p- and n-type Seebeck coefficients, leading to transverse relation between net heat and net electrical current. One feature of such materials is that they can operate near intrinsic doping and, therefore will not suffer from dopant freeze-out, opening the possibility of new cryogenic operation for solid state cooling. In this work, a Seebeck tensor analysis of thermoelectric materials is presented. To compare the performance of transverse thermoelectric materials, a transverse power factor PF⊥ is introduced. Materials searches based on these simple criteria reveal that over 1/4 of the database of about 48,000 inorganic materials could potentially function as (p × n)-type TTE’s, demonstrating the underappreciated prevalence of this class of materials.

BiCuTeO is a potential thermoelectric material owing to its low thermal conductivity and high carrier concentration. However, the thermoelectric performance of BiCuTeO is still below average and has much scope for improvement. In this study, we manipulated the nominal oxygen content in BiCuTeO and synthesized BiCuTeOx (x = 0.94–1.06) bulks by a solid-state reaction and pelletized them by a cold-press method. The power factor was enhanced by varying the nominal oxygen deficiency due to the increased Seebeck coefficient. The thermal conductivity was also reduced due to the decrease in lattice thermal conductivity owing to the small grain size generated by the optimal nominal oxygen content. Consequently, the ZT value was enhanced by ∼11% at 523 K for stoichiometric BiCuTeO0.94 compared to BiCuTeO. Thus, optimal oxygen manipulation in BiCuTeO can enhance the thermoelectric performance. This study can be applied to developing oxides with high thermoelectric performances.

Thermal conductivity of a nickel-coated tri-wall carbon nanotube was studied using molecular dynamics where both the phonon and electron contributions were considered. Simulations predicted a significant effect of the metal coating on the thermal conductivity, i.e. 50% decrease for 1.2 nm of Ni coating. However, the decreasing rate of the thermal conductivity is minuscule for the metal thicker than 1.6 nm. The smaller thermal conductivity of the metal coating, phonon scattering at the interface, and less impacted heat transfer on the inner tubes of the carbon nanotube rationalized the observed trends.