Correlating atomic configurations—specifically, degree of disorder (DOD)—of an amorphous
solid with properties is a long-standing riddle in materials science and condensed matter …

Two-dimensional (2D) materials, consisting of atomically thin layered crystals, have attracted
tremendous interest due to their outstanding intrinsic properties and diverse applications in …

We investigate electronic transport properties of copper–graphene (Cu–G) composites using
a density-functional theory (DFT) framework. Conduction in composites is studied by varying …

Amorphous carbon (aC) has attracted considerable interest due to its desirable properties,
which are strongly dependent on its structure, density and impurities. Using ab initio …

Two-dimensionally extended amorphous carbon (“amorphous graphene”) is a prototype
system for disorder in 2D, showing a rich and complex configurational space that is yet to be …

Carbon fibers exhibit a wide range of structures including crystalline, amorphous, and
partially crystalline arrangements. Research on disordered carbon has recently unveiled …

Data-driven interatomic potentials based on machine-learning approaches have been
increasingly used to perform large-scale, first-principles quality simulations of materials in …

This paper explores the transport properties of aluminum-carbon composite material via ab
initio methods. Interfacial and electronic dynamics of the aluminum-graphene interface …

Bituminous coal was utilized as a particulate filler in polymer-based composites to fabricate
standard 1.75 mm coal-plastic composite filaments for material extrusion 3D printing. The …

The electronic conduction properties of copper–graphene composite materials including
common coal impurities are studied. Exploring the transport properties for three …