New theoretical insights for and from accurate quantum dynamics simulations of molecular systems (Tutorial for March 8 workshop)
Taner Ture
This tutorial gives background information and preview for the workshop on March 8, which invites leading experts in quantum dynamics calculation and simulation of molecular systems at various length and time scales. Please read the papers listed below for more information. .
Resources
Ignacio Franc - https://www.pnas.org/doi/10.1073/pnas.2309987120
Andres Montoya-Castillo - https://pubs.aip.org/aip/jcp/article/151/7/074111/197927
https://pubs.aip.org/aip/jcp/article/159/24/244114/2931601
David Coker - https://nam02.safelinks.protection.outlook.com/?url=https%3A%2F%2Fpubs.aip.org%2Faip%2Fjcp%2Farticle%2F155%2F1%2F014108%2F313220&data=05%7C02%7CSeogjoo.Jang%40qc.cuny.edu%7Cb8b8900634ac4f4df01408dc3bc6ac90%7C6f60f0b35f064e099715989dba8cc7d8%7C0%7C0%7C638450971702664010%7CUnknown%7CTWFpbGZsb3d8eyJWIjoiMC4wLjAwMDAiLCJQIjoiV2luMzIiLCJBTiI6Ik1haWwiLCJXVCI6Mn0%3D%7C0%7C%7C%7C&sdata=%2F25dJlPWje0lnz%2FuB26F%2FRBKsE1%2Ff1%2FqwWep3rVHiDQ%3D&reserved=0
https://nam02.safelinks.protection.outlook.com/?url=https%3A%2F%2Fpubs.aip.org%2Faip%2Fjcp%2Farticle%2F154%2F22%2F224109%2F313356&data=05%7C02%7CSeogjoo.Jang%40qc.cuny.edu%7Cb8b8900634ac4f4df01408dc3bc6ac90%7C6f60f0b35f064e099715989dba8cc7d8%7C0%7C0%7C638450971702672943%7CUnknown%7CTWFpbGZsb3d8eyJWIjoiMC4wLjAwMDAiLCJQIjoiV2luMzIiLCJBTiI6Ik1haWwiLCJXVCI6Mn0%3D%7C0%7C%7C%7C&sdata=DCQIFAxqQgNSTKuxhxvS4lh%2Fqf9XcIKZT4TNtv3Boq4%3D&reserved=0
https://nam02.safelinks.protection.outlook.com/?url=https%3A%2F%2Fpubs.acs.org%2Fdoi%2F10.1021%2Facs.jctc.0c01035&data=05%7C02%7CSeogjoo.Jang%40qc.cuny.edu%7Cb8b8900634ac4f4df01408dc3bc6ac90%7C6f60f0b35f064e099715989dba8cc7d8%7C0%7C0%7C638450971702679160%7CUnknown%7CTWFpbGZsb3d8eyJWIjoiMC4wLjAwMDAiLCJQIjoiV2luMzIiLCJBTiI6Ik1haWwiLCJXVCI6Mn0%3D%7C0%7C%7C%7C&sdata=TmmCkZGRRo4wA%2BlLQ7enFulITtx8KKa00mUEhE4fMg8%3D&reserved=0
Doran Raccah - https://pubs.aip.org/aip/jcp/article/158/17/174103/2887556/Simulating-optical-linear-absorption-for-mesoscale
ORGANIZER
Seogjoo J. Jang, PhD
Professor, Department of Chemistry and Biochemistry
Queens College, City University of New York