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Quantum Matters in Material Sciences (QMMS)

QMMS Conference 2024

As part of the JARVIS workshop series, the National Institute of Standards and Technology (NIST) is organizing the 4th Quantum Matters in Materials Science (QMMS) workshop in-person on Feb 19-20, 2025. The workshop will be focused on quantum phenomena in emerging materials for next generation devices. All materials are inherently quantum in nature, but when quantum phenomena manifest at the classical scale can we hope to leverage their properties for applications. Large scale initiatives such as the Materials Genome Initiative, the National Quantum Initiative, and the CHIPS for America Act represent compelling approaches to investigate quantum materials and accelerate their development for quantum information systems (QIS), for the use in future integrated circuits, and other practical industrial applications. For these approaches and initiatives to be successful, it is essential to have good synergy between experimental and computational efforts. This workshop aims at streamlining this effort. To make the workshop as effective as possible, we plan to mainly focus on 2D and 3D inorganic superconductor, topological, magnetic, and semiconducting materials, but we are not limited to those systems.

 

Some of the key topics to be addressed by both theory and experiments are:

1) discovery and characterization of new superconductors/topological, magnetic, and semiconducting materials,

2) optimization of known quantum materials,

3) investigation of defect induced behavior and transitions,

4) electronics, spintronics, and quantum memory applications,

5) challenges in applying QIS technologies at industrial scale,

6) successes and challenges in integrating next-generation materials into integrated circuits (microchips),

7) the role of material interfaces at the quantum level,

8) high fidelity many-body computational methods to treat quantum materials,

9) applications for quantum computing and quantum simulations.

 

CALL FOR ABSTRACTS

If registered participants are interested in presenting a poster, please send name, affiliation, title, and abstract to nia.rodney-pollard [at] nist.gov (nia[dot]rodney-pollard[at]nist[dot]gov) no later than 1/31/2025.

Day 1: February 19, 2025

Session 1: 9:00am – 12:30pm
9:00am – 9:10amOpening RemarksMark VanLandingham
9:10am – 9:20amOverview and LogisticsDaniel Wines
9:20am – 9:40amFrom Data to Discovery: Advancing Machine Learning for Materials ScienceAldo Romero
9:40am – 10:00amGerhard Klimeck 
10:00am – 10:20am: Break/Group Photo
10:20am – 10:40amFinding the perfect imperfection: Accelerating the search of quantum defects using high-throughput computing Geoffroy Hautier
10:40am – 11:00amUnderstanding Ferroelectric Hafnia Under Pressure: Phase Transitions and Elastic AnomaliesSobhit Singh
11:00am – 11:20am: Break
11:20am – 11:40amHunting antiferromagnetic ordering in altermagnetic candidate RuO2 thin filmsSteven Bennett
11:40am – 12:00pmDetection of Short-Range Antiferromagnetism Through Exchange Interaction of Altermagnetic Candidate RuO2Frank Abel
12:00pm – 12:20pmA Quasiparticle Soup in Layered CoTiO3: Phonons, Magnons, and Spin Orbit ExcitonsAngela Hight Walker
12:30pm – 1:30pm: Lunch
Session 2: 1:30pm – 3:10pm
1:30pm – 1:50pmExploring Molecules and Clusters using QuantumAndre Clayborne
1:50pm – 2:10pmClassical to Semiclassical Transition state theory for chemical reactions in complex environmentsRigoberto Hernandez
2:10pm – 2:30pm: Break
2:30pm – 2:50pmA deep dive into Sample-Based Quantum Diagonalization methodsJavier Robledo Moreno
2:50pm – 3:10pmClassical and quantum algorithms for spin relaxation processesKade Head-Marsden
Poster Session: 3:15pm – 5:00pm

Day 2: February 20, 2025

Session 1: 9:00am – 12:30pm
9:00am – 9:20amMetal coordinated DNA(Anant) M. P. Anantram
9:20am – 9:40amRichard Hennig 
10:00am – 10:20am: Break
10:20am – 10:40amAnders Blom 
10:40am – 11:00amExactness for all one-electron densities: the most obvious and least tractable exact constraint in density functional theoryJohn Perdew
11:00am – 11:10amSuperconducting bilayer nickelates: Structural properties, optical excitations, and Fermi surface engineering via strainBenjamin Geisler
11:10am – 11:30am: Break
11:30am – 11:50amResearch Pathway to 2D TMD Semiconductor IndustrializationKevin O'Brien
11:50am – 12:10pmTextured spintronic materials for scalable non-volatile memoryDaniel Gopman
12:10pm – 12:30pm2D Materials for Next-Generation Electronics: From Low-Power Logic to Monolithic MemoryDeep Jariwala
12:30pm – 1:30pm: Lunch
Session 2: 1:30pm – 3:30pm
1:30pm – 1:45pmDTRA and Quantum Sensors for DetectionJennifer R. Soliz
1:45pm – 2:05pmQuantum phenomena in MXenes: charge- and magneto-transportFrancesca Urban
2:05pm – 2:25pmIn-Operando Spatiotemporal Imaging of Coupled Film-Substrate Elastodynamics during an Insulatorto-Metal TransitionVenkatraman Gopalan
2:25pm – 2:40pm: Break
2:40pm – 3:00pmAI-driven search and discovery of new superconductorsIchiro Takeuchi
3:00pm – 3:20pmQuantum photonic integrated circuit components: progress and challengesKartik Srinivasan
3:20pm – 3:30pm: Closing Remarks

Sobhit SinghRochester
Venkatraman GopalanPenn State
Aldo RomeroWest Virginia
Geoffroy HautierDartmouth
Steven BennettNRL
Andre ClayborneGeorge Mason
Frank AbelNaval Academy/NIST
Ichiro TakeuchiUMD
Gerhard KlimeckPurdue 
Richard HennigFlorida
Benjamin GeislerFlorida
Rigaberto HernandezJohns Hopkins
Javier Robledo Moreno IBM
Angela Hight WalkerNIST
Deep JariwalaUPenn
(Anant) M. P. AnantramUniversity of Washington
Kartik SrinivasanNIST
Francesca UrbanDrexel
John PerdewTulane
Anders BlomSynopsys Inc
Kade Head-MarsdenUMN
Bob KellerCHIPS/NIST
Kevin O'BrienIntel

 

A room block has been reserved at the following location:

Sheraton Rockville

Address: 920 King Farm Blvd, Rockville, MD 20850

Rate: $119/person (plus tax). Rate includes shuttle to and from NCCoE for both days of the workshop.

CLICK HERE to book your room

Last day to book your room: January 27, 2025

Created September 17, 2024, Updated February 12, 2025