Quantum Dynamics

Quantum Dynamics

ORAL · Y01 · ID: 48429

Presentations

Quantum Scrambling in Molecules .

ORAL

March 18, 2022, 9:00 AM – March 18, 2022, 9:12 AM

Publication: Submitted to PRL: Quantum Scrambling in Molecules Chenghao Zhang, Peter G. Wolynes, and Martin Gruebele,
Presenters
- Chenghao Zhang
 
 University of Illinois at Urbana-Champaign
Authors
- Chenghao Zhang
 
 University of Illinois at Urbana-Champaign
- Martin Gruebele
 
 University of Illinois at Urbana-Champaign
- Peter G Wolynes
 
 Rice University, Rice Univ
View abstract →
Generation of entangled photon pair from biexciton cascade decay in quantum dots

ORAL

March 18, 2022, 9:12 AM – March 18, 2022, 9:24 AM
Presenters
- Arindam Chakraborty
  
  Syracuse University
Authors
- Arindam Chakraborty
  
  Syracuse University
- Nicole Spanedda
  
  Syracuse University
View abstract →
Statistical Correlation Between Quantum Entanglement and Spin-Orbit Coupling in Crossed Beam Molecular Dynamics

ORAL

March 18, 2022, 9:24 AM – March 18, 2022, 9:36 AM
Presenters
- Sumit S Kale
  
  Purdue University
Authors
- Sumit S Kale
  
  Purdue University
- Sabre Kais
  
  Purdue University
- Junxu Li
  
  Purdue University
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Polariton-mediated coupling of spatially separated quasi-degenerate porphyrin excitons.

ORAL

March 18, 2022, 9:36 AM – March 18, 2022, 9:48 AM
Presenters
- Aleksandr Avramenko
  
  Wayne State University
Authors
- Aleksandr Avramenko
  
  Wayne State University
- Aaron Rury
  
  Wayne State University
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The role of topological disorder and heterogeneity on the dissolution kinetics of glasses

ORAL

March 18, 2022, 9:48 AM – March 18, 2022, 10:00 AM

Publication: The role of topological disorder and heterogeneity on the dissolution kinetics of glasses (planned submission November 2021)
Presenters
- Luis A Ruiz Pestana
  
  University of Miami
Authors
- Luis A Ruiz Pestana
  
  University of Miami
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Ammonia formation on hexagonal Molybdenum Nitride Surfaces using DFT with added van der Waals effects

ORAL

March 18, 2022, 10:00 AM – March 18, 2022, 10:12 AM

Publication: Some part of this work is submitted to ACS Omega
Presenters
- Muhammad Sajid
  
  University of Central Florida
Authors
- Muhammad Sajid
  
  University of Central Florida
- William Kaden
  
  University of Central Florida
- Abdelkader Kara
  
  University of Central Florida
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Characterization of light-induced potentials in the strong-field dissociation of O2+

ORAL

March 18, 2022, 10:12 AM – March 18, 2022, 10:24 AM

Publication: P. M. Abanador and U. Thumm, Phys. Rev. A 102, 053114 (2020).
Presenters
- Paul Abanador
 
 Kansas State University
Authors
- Paul Abanador
 
 Kansas State University
- Uwe Thumm
 
 Kansas State University
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Insights into the formation of methane and methanol via photocatalytic water splitting in in the presence of methyl iodide on a TiO2(100) surface

ORAL

March 18, 2022, 10:24 AM – March 18, 2022, 10:36 AM
Presenters
- MIhai E Vaida
 
 University of Central Florida
Authors
- MIhai E Vaida
 
 University of Central Florida
View abstract →
Quantum dynamics simulation of intramolecular singlet fission in covalently linked tetracene dimer

ORAL

March 18, 2022, 10:36 AM – March 18, 2022, 10:48 AM

Publication: https://arxiv.org/abs/2107.13948
Presenters
- Sam Mardazad
  
  LMU Munich
Authors
- Sam Mardazad
  
  LMU Munich
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Non-Hermitian topology in a spatially-extended system of chemical reactions

ORAL

March 18, 2022, 10:48 AM – March 18, 2022, 11:00 AM

Publication: N/A
Presenters
- Tamoghna Das
  
  Institute for Basic Science
Authors
- Tamoghna Das
  
  Institute for Basic Science
- Tsvi Tlusty
  
  Institute for Basic Science
View abstract →
Exploring Chiral-Induced Spin Selectivity using Nitrogen–Vacancy Centers in Diamond

ORAL

March 18, 2022, 11:00 AM – March 18, 2022, 11:12 AM
Presenters
- John M Abendroth
  
  ETH Zurich
Authors
- John M Abendroth
  
  ETH Zurich
View abstract →
Quantum Monte Carlo study on Van der Waals interactions in hydrogen adsorption on a silicon-carbide nanotube

ORAL

March 18, 2022, 11:12 AM – March 18, 2022, 11:24 AM

Publication: G. I. Prayogo, H. Shin, A. Benali, R. Maezono, K. Hongo, Importance of Van der Waals Interactions in Hydrogen Adsorption on a Silicon-carbide Nanotube Revisited with vdW-DFT and Quantum Monte Carlo, ACS Omega 6, 38, 24630–24636 (2021), DOI: 10.1021/acsomega.1c03318
Presenters
- Genki I Prayogo
  
  School of Information Science, JAIST, Nomi, Ishikawa, Japan, School of Information Science, JAIST
Authors
- Genki I Prayogo
  
  School of Information Science, JAIST, Nomi, Ishikawa, Japan, School of Information Science, JAIST
- Hyeondeok Shin
  
  Computational Science Division, Argonne National Laboratory, Argonne, IL, United States
- Anouar Benali
  
  Computational Science Division, Argonne National Laboratory, Computational Science Division, Argonne National Laboratory, Argonne, IL, United States, Argonne National Labratory, Argonne National Laboratory
- Ryo Maezono
  
  School of Information Science, JAIST, School of Information Science, JAIST, Nomi, Ishikawa, Japan, School of Information Science, JAIST, Nomi, Ishikawa, Japan.
- Kenta Hongo
  
  Research Center for Advanced Computing Infrastructure, JAIST, Research Center for Advanced Computing Infrastructure, JAIST, Nomi, Ishikawa, Japan, Research Center for Advanced Computing Infrastructure, JAIST, Nomi, Ishikawa, Japan.
View abstract →
Benchmark all-electron ab initio quantum Monte Carlo calculations with Antisymmetrized Geminal Power (AGP) and Pfaffian Ansatz for G2-set molecules using TurboRVB package

ORAL

March 18, 2022, 11:24 AM – March 18, 2022, 11:36 AM

Publication: Planned paper: Benchmark all-electron ab initio quantum Monte Carlo calculations with Antisymmetrized Geminal Power (AGP) and Pfaffian Ansatz for G2-set molecules using TurboRVB package
Presenters
- Abhishek Raghav
  
  School of Information Science, JAIST
Authors
- Abhishek Raghav
  
  School of Information Science, JAIST
- Ryo Maezono
  
  School of Information Science, JAIST, School of Information Science, JAIST, Nomi, Ishikawa, Japan, School of Information Science, JAIST, Nomi, Ishikawa, Japan.
- Kenta Hongo
  
  Research Center for Advanced Computing Infrastructure, JAIST, Research Center for Advanced Computing Infrastructure, JAIST, Nomi, Ishikawa, Japan, Research Center for Advanced Computing Infrastructure, JAIST, Nomi, Ishikawa, Japan.
- Sandro Sorella
  
  International School for Advanced Studies, Condensed Matter Theory group, SISSA
- Kousuke Nakano
  
  1. International School for Advanced Studies 2. School of Information Science, JAIST, School of Information Science, JAIST, School of Information Science, JAIST, Nomi, Ishikawa, Japan., Condensed matter theory, SISSA
View abstract →
Semi-empirical Quantum Optics for Mid-Infrared Molecular Nanophotonics

ORAL

March 18, 2022, 11:36 AM – March 18, 2022, 11:48 AM

Publication: [1] J.F. Triana et al., arXiv:2110.07371, 2021. [2] A.B. Grafton et al., Nature Communications 12, 214, 2021. [3] J.F. Triana, F.J. Hernández & F. Herrera, J. Chem. Phys. 152, 234111, 2020. [4] F. Herrera and J. Owrutsky, J. Chem. Phys. 152, 100902, 2020. [5] F. Hernández and F. Herrera, J. Chem. Phys. 151, 144116, 2019.
Presenters
- Felipe Herrera
 
 Univ de Santiago de Chile
Authors
- Felipe Herrera
 
 Univ de Santiago de Chile
- Johan F Triana
 
 Univ de Santiago de Chile
- Mauricio Arias
 
 Universidad de Concepción
- Jun Nishida
 
 University of Colorado, Boulder
- Markus B Raschke
 
 University of Colorado, Boulder
- Roland Wilcken
 
 University of Colorado Boulder
- Eric Muller
 
 Colgate University
- Samuel C Johnson
 
 University of Colorado, Boulder
- Aldo Delgado
 
 Universidad de Concepción
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