Non-planar and curved architectures of otherwise flat 2D materials present an important paradigm for nanoscale analysis and design of emergent material properties. Atomically-thin transition metal dichalcogenides (TMDs) have emerged at the forefront of the 2D materials field in recent years largely due to their attractive and tunable chemical, optical, and...
Exploratory phase stability analysis in Materials Science has two primary goals: (a) Characterizing the evolution of the materials single phase field in composition space to identify solubility and electronic dopability limits and (b) Accelerated prediction of new phases of technological importance. In this thesis we reorganize defect theory --- the...
The era of quantum information science (QIS) can usher revolutionary new capabilities ranging from quantum computation to quantum sensing. At the core of these technologies is the fundamental unit of QIS, the quantum bit or qubit. The power of qubits over their classical counterparts lies in their ability to be...
Continuous and coordinated materials discovery efforts have amassed a wealth of knowledge concerning many general classes of materials. The number of known phases of all structure-types, however, is far less than number of possible materials dictated by the elements on the periodic table. Recently, with improved computational abilities and well-developed...
Advanced wireless soft electronics integrate a wireless power transfer circuit and a small battery. It is skin-compliant, and lightweight accommodating the complex motion of the body. These unique features of the device provide a continuous physiological measurement without discomfort and spatial constraints. Using the device, we can observe and track...
Discrete molecules, linear and branched polymers, and disordered cross-linked networks are well studied objects of chemical synthesis. However, two-dimensional polymers (2DPs) have been long missing from this continuum of molecular architectures, both in chemical synthesis and in Nature. Recently, new polymerization strategies and characterization methods have enabled the unambiguous realization...
Throughout history, the development of materials has relied heavily on the empirical judgment of scientists and engineers and on prolonged experiments proton to errors. Due to the complexity of material behavior, successful discovery of new candidates has been serendipitous, and down-selection of candidates remains a time-consuming process that requires repetitive...
Thermoelectric materials are of particular interest in a variety of fields because of their ability to directly convert heat to electricity (and vice versa), however, they struggle to gain widespread adoption because of their low efficiency. A common strategy in the field of thermoelectricity is to introduce material defects into...
High performance polymers and their composites have wide ranging application in advanced and emerging material systems. The macroscale performance of these advanced materials is often defined by interfaces that induce nanoscale changes in the microstructure or molecular conformations (termed the ‘interphase’) of the polymer. Atomic force microscopy (AFM) is an...
Given directives such as the UN Global Goals targeting sustainable development, the research presented herein makes but a small contribution to the advancement of alternative energy technologies. Nevertheless, the present work was largely motivated to address specific points of intrigue within the thermoelectrics community. The general principles demonstrated, however, may...