
Applicationdriven CoDesign: Using Proxy Apps in the ASCR Materials CoDesign Center
31 May 2012   Contributor(s):: Jim Belak
Computational materials science is performed with a suite of applications that span the quantum mechanics of interatomic bonding to the continuum mechanics of engineering problems and phenomenon specific models in between. In this talk, we will review this suite and the motifs used in each of...

Bringing Quantum Mechanics to Life: From Schrödinger's Cat to Schrödinger's Microbe
01 Nov 2016   Contributor(s):: Tongcang Li
In this talk, I will first give a brief introduction to basic concepts in quantum mechanics and the Schrödinger's cat thought experiment. I will then review developments in creating quantum superposition and entangled states and the realization of quantum teleportation. Nontrivial quantum...

Development of the ReaxFF reactive force fields and applications to combustion, catalysis and material failure
12 Sep 2011   Contributor(s):: Adri van Duin
This lecture will describe how the traditional, nonreactive FFconcept can be extended for application including reactive events by introducing bond order/bond distance concepts. Furthermore, it will address how these reactive force fields can be trained against QMdata, thus greatly enhancing...

Dynamics of Quantum Fluids: Path integral and Semiclassical Methods
21 May 2008   Contributor(s):: Nancy Makri
The interplay of manybody nonlinear interactions and quantum mechanical effects such as zeropoint motion or identical particle exchange symmetries lead to intriguing phenomena in lowtemperature fluids, some of which remain poorly understood. Recent advances in theory and methodology have...

E304 L3.1.2: Nanoscale Physics  Planck's Contribution to Quantum Mechanics
26 Feb 2016 

E304 L5.2.1: Nanomechanics  Quantum Mechanics of Oscillation
29 Mar 2016   Contributor(s):: Elena Nicolescu Veety

ECE 606 Lecture 2: Quantum Mechanics
31 Aug 2012   Contributor(s):: Gerhard Klimeck

ECE 606 Lecture 3: Elements of Quantum Mechanics
28 Jan 2009   Contributor(s):: Muhammad A. Alam
Outline:Why do we need quantum physicsQuantum conceptsFormulation of quantum mechanicsConclusions

ECE 606 Lecture 4: Periodic Potentials Solutions of Schrödinger's Equation
14 Sep 2012   Contributor(s):: Gerhard Klimeck

ECE 606 Lecture 4: Solution of Schrodinger Equation
04 Feb 2009   Contributor(s):: Muhammad A. Alam
Outline:Timeindependent Schrodinger EquationAnalytical solution of toy problemsBound vs. tunneling statesConclusionsAdditional Notes: Numerical solution of Schrodinger Equation

ECE 612 Lecture 4: Polysilicon Gates/QM Effects
12 Sep 2008   Contributor(s):: Mark Lundstrom
Outline: 1) Review, 2) Workfunctionof poly gates,3) CV with poly depletion,4) Quantum mechanics and VT,5) Quantum mechanics and C,6) Summary.

Electrons in Two Dimensions: Quantum Corrals and Semiconductor Microstructures
04 Dec 2007   Contributor(s):: Eric J. Heller
The images generated by a scanning tunneling microscope are iconic. Some of the most famous are Don Eigler’s quantum corrals, which reveal not only the guest atoms on a surface but especially the interference patterns of electrons shuttling back and forth along the surface. To understand the...

Finite Size Scaling and Quantum Criticality
09 May 2007   Contributor(s):: Sabre Kais
The study of quantum phase transitions, which are driven by quantum fluctuations as a consequence of Heisenberg's uncertainty principle, continues to be of increasing interest in the fields of condensed matter and atomic and molecular physics. In this field we have established an analogy between...

Introduction to Quantum Dot Lab
31 Mar 2008   Contributor(s):: Sunhee Lee, Hoon Ryu, Gerhard Klimeck
The nanoHUB tool "Quantum Dot Lab" allows users to compute the quantum mechanical "particle in a box" problem for a variety of differentconfinement shapes, such as boxes, ellipsoids, disks, and pyramids. Users can explore, interactively, the energy spectrum and orbital shapes of new quantized...

Lecture 1: The Wigner Formulation of Quantum Mechanics
18 Nov 2014   Contributor(s):: Jean Michel D Sellier
In this lecture, Dr. Sellier discusses the Wigner formulation of Quantum Mechanics which is based on the concept of quasidistributions defined over the phasespace.

Lecture 2: The Wigner Monte Carlo Method for SingleBody Quantum Systems
18 Nov 2014   Contributor(s):: Jean Michel D Sellier
In this lecture, Dr. Sellier discusses the Wigner Monte Carlo method applied to singlebody quantum systems.

Lecture 3: The Wigner Monte Carlo Method for Density Functional Theory
18 Nov 2014   Contributor(s):: Jean Michel D Sellier
In this lecture, Dr. Sellier discusses the Wigner Monte Carlo method in the framework of density functional theory (DFT).

Lecture 4: The abinitio Wigner Monte Carlo Method
18 Nov 2014   Contributor(s):: Jean Michel D Sellier
In this lecture, Dr. Sellier discusses the abinitio Wigner Monte Carlo method for the simulation of strongly correlated systems.

Lecture 5: Systems of Identical Fermions in the Wigner Formulation of Quantum Mechanics
18 Nov 2014   Contributor(s):: Jean Michel D Sellier
In this lecture, Dr. Sellier discusses about systems of indistinguishable Fermions in the Wigner formulation of quantum mechanics.

ME 597 Lecture 1: Introduction to Basic Quantum Mechanics
01 Sep 2009   Contributor(s):: Ron Reifenberger
Note: This lecture has been revised since its original presentation.Topics:Introduction to Basic Quantum MechanicsEnergy States in Periodic Crystals