7.7k citations · 7.8k across the 4 of their papers we have counts for
13 papers
Advanced modeling of materials with PAOFLOW 2.0: New features and software design
Frank T. Cerasoli, Andrew R. Supka, Anooja Jayaraj +7
Recent research in materials science opens exciting perspectives to design novel quantum materials and devices, but it calls for quantitative predictions of properties which are no…
A systematic variational approach to band theory in a quantum computer
Kyle Sherbert, Frank Cerasoli, Marco Buongiorno Nardelli
Quantum computers promise to revolutionize our ability to simulate molecules, and cloud-based hardware is becoming increasingly accessible to a wide body of researchers. Algorithms…
Hyperbolic metamaterials with extreme mechanical hardness
Arrigo Calzolari, Alessandra Catellani, Marco Buongiorno Nardelli +1
Hyperbolic metamaterials (HMMs) are highly anisotropic optical materials that behave as metals or as dielectrics depending on the direction of propagation of light. They are becomi…
Discovery of Higher-Order Topological Insulators using the Spin Hall Conductivity as a Topology Signature
Marcio Costa, Gabriel R. Schleder, Carlos Mera Acosta +4
The discovery and realization of topological insulators, a phase of matter which hosts metallic boundary states when the -dimension insulating bulk is confined to ()-dimens…
Quantum computation of silicon electronic band structure
Frank T. Cerasoli, Kyle Sherbert, Jagoda Sławińska +1
Development of quantum architectures during the last decade has inspired hybrid classical-quantum algorithms in physics and quantum chemistry that promise simulations of fermionic…
Toward Realistic Amorphous Topological Insulators
Marcio Costa, Gabriel R. Schleder, Marco Buongiorno Nardelli +2
The topological properties of materials are, until now, associated with the features of their crystalline structure, although translational symmetry is not an explicit requirement…