Introduction to Applications of Quantum Computing to Quantum Chemistry - Class 2
Explore quantum computing applications in quantum chemistry, focusing on advanced concepts and practical implementations.
Large Anomalous Hall Conductivity in CoS2
Explore the anomalous Hall conductivity in CoS2, examining its pyrite structure, ferromagnetic properties, and electronic characteristics through experimental data and DFT results.
Numerical Methods for Scattering and Resonance Properties in Molecules and Solids
Explore numerical methods for discretizing continuum states in electronic structure, addressing scattering, photo-ionization, and resonances. Learn efficient computational techniques with applications in condensed matter physics and chemistry.
Demystifying Density Functional Theory: From Fundamentals to Applications
Uncover the fundamental principles and applications of Density Functional Theory (DFT), exploring its role in physics, chemistry, and biology while understanding its operational framework and research potential.
Band Structure Transformation of the Avoided Crossing Type in Impure Graphene
Explore the band structure transformations in impure graphene, focusing on avoided crossing phenomena and their implications for theoretical physics.
Go EAST, Young Scientist - First Principles View on Chemical Compound Space
Explore chemical compound space through first principles and machine learning, gaining insights into atomistic and electronic structures for efficient materials discovery and understanding.
Flat Bands in Twisted Bilayer Transition Metal Dichalcogenides by Manish Jain
Explore flat bands in twisted bilayer transition metal dichalcogenides, focusing on Moire patterns, electronic structure, and localization effects in various twist angles and stacking configurations.
Randomized Methods for Quantum Many-Body Problems - A Mathematical Primer
Explore randomized methods for quantum many-body problems, focusing on Monte Carlo techniques to approximate ground and excited states in large systems. Learn about VMC and FCIQMC algorithms.
Stochastic Vector Methods for Extended Systems - IPAM at UCLA
Explore stochastic vector approaches for electronic structure in condensed matter systems, reducing complexity and enhancing efficiency in computational quantum mechanics.
Mathematical Models of Electronic Structure - IPAM at UCLA
Explore mathematical models of electronic structure, focusing on quantum mechanics applications in materials science and chemistry, presented by Duke University expert Jianfeng Lu.
Revealing Electronic Structure and Topological States of Charge Density Wave Compounds
Explore electronic structure and topological states in charge density wave compounds, focusing on transition metal tetrachalcogenides and their unique properties in ultra-high magnetic fields.
Disorder in Multi-Band Topological Semimetals
Exploring disorder effects in topological magnetic semimetals, focusing on exotic transport properties, Berry curvature, and intrinsic anomalous Hall effect in various material systems.
Density Functional Theory: Introduction and Applications
Explore Density Functional Theory fundamentals and applications using Quantum Espresso on nanoHUB. Learn to compute electronic structures, densities of state, total energies, and bulk modulus for materials.
Getting from DaFT to DeFT: An Introduction to Using DFT for 2D Materials
Comprehensive introduction to Density Functional Theory for 2D materials, covering fundamental concepts, applications, and practical implementation techniques.
When and Why Do We Have Unconventional Behavior in Van Der Waals Bilayers?
Explore unconventional behavior in van der Waals bilayers, focusing on emergent electronic, magnetic, and topological phenomena in 2D synthetic quantum material structures.
Layer-Resolved Electronic Structure of Oxide Heterostructures using High Energy X-Ray Spectroscopy
Explore layer-resolved electronic structure of oxide heterostructures using high-energy techniques. Gain insights into emergent phenomena in 2D quantum materials and their potential applications.
A Tale of Two Kinds of Superconducting Nickelates
Explore superconducting nickelates in this talk on engineered 2D quantum materials, covering recent developments in electronic, magnetic, and topological phenomena in synthetic structures.
Introduction to Q-Chem Software Package - Session 1
Explore Q-Chem software: features, community, and applications in computational chemistry. Learn about ground state methods, excited states, and molecular dynamics simulations.
Density Functional Theory Overview - 2023 Virtual Winter School in Computational Chemistry
Explore density functional theory methods with Prof. Martin Head-Gordon, covering key concepts, functional design, and performance analysis in computational chemistry.
Molecular Properties and Spectra Using DFT and TDDFT - Session 6
Explore DFT and TDDFT applications in molecular properties and spectra with Prof. Martin Head-Gordon. Covers first/second-order properties and excited states, with accompanying lab exercise.
Lattice Reconstruction, Piezoelectricity, and Topology in Twisted MoTE2
Explore lattice reconstruction, piezoelectricity, and topology in twisted MoTE2 with expert Di Xiao, delving into advanced condensed matter physics concepts and their applications.