Group Seminars

Seminars 2013

Month Date Time Presented By About
February 7th 3:15 pm Meeting with Randall Snurr Discussion of NMGC Projects
February 14th 4:00 pm Nora Planas ALD in NU-1000 Project
February 21st 4:00 pm Literature Meeting - Allison Dzubak and Rémi Maurice Short Alkane Adsorption in Chabazite
February 28th 4:00 pm Sarah Yao Studying Emission Spectra of Uranyl Coordination Polymers
March 6th (Wednesday) 4:00 pm Rémi Maurice Electronic structure of transition ions
March 14th 4:00 pm Literature Meeting - Bess Vlaisavljevich and Sarah Yao Oxo-Functionalization and Reduction of the Uranyl Ion
March 21st 4:00 pm Giovanni Li Manni Addressing Comments on the SplitGAS Paper
March 28th 3:30 pm Josh Borycz A Mixed level approach to computing CO2 adsorption in Fe-MOF-74
April 4th 4:00 pm David Semrouni En route to the free energy of encapsulation in Metal-Organic Cages
April 11th 4:00 pm Literature Meeting - Rebecca Carlson and Dongxia Ma BSSE and CC with autoionizing excited states
April 18th 4:00 pm Chad Hoyer Bonding in Two-Coordinate Mn Complexes
April 25th 4:00 pm Dongxia Ma Improving MCSCF in NWChem
May 2nd 4:00 pm Bess Vlaisavljevich and Sarah Yao Molecular dynamics of uranyl-peroxide nanocapsules
and Emission Spectra of Uranyl Coordination Polymers
May 9th 4:00 pm Literature Meeting - Huilang Shi and Nora Planas NMR study of small molecule adsorption in MOF-74-Mg
May 16th 4:00 pm Nora Planas and Joshua Borycz CO2 Adsorption Mechanism in Functionalized Mg-MOF-74
and Update on Periodic DFT FF Parameterization and FeMOF74 O2
Interactions
May 23rd 4:00 pm Allison Dzubak TBA
May 30th 4:00 pm Rebecca Carlson and Huilang Shi TBA
June 6th 4:00 pm Literature Meeting - Chad Hoyer and Giovanni Li Manni TBA
June 11th 4:00 pm Bess Vlaisavljevich Practice PhD Defense
June 20th 4:00 pm Huilang Shi TBA
June 27th 4:00 pm Rémi Maurice and Joshua Borycz The Theory and Practice of Periodic DFT
July 11th 4:00 pm Literature Meeting - Joshua Borycz and David Semrouni TBA
July 18th 4:00 pm Nora Planas and Dongxia Ma TBA

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