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The Journal of Physical Chemistry. A
|
December 23, 2016
Depolymerization Pathways for Branching Lignin Spirodienone Units Revealed with ab Initio Steered Molecular Dynamics
Brendan D Mar, Heather J Kulik
The Journal of Physical Chemistry. A
|
July 8, 2016
Adapting DFT+U for the Chemically Motivated Correction of Minimal Basis Set Incompleteness
Heather J Kulik, Natasha Seelam, Brendan D Mar, et al.
The Journal of Physical Chemistry. A
|
May 23, 2015
Ab Initio Screening Approach for the Discovery of Lignin Polymer Breaking Pathways
Brendan D Mar, Helena W Qi, Fang Liu, et al.
The Journal of Physical Chemistry. B
|
August 23, 2013
The charge transfer problem in density functional theory calculations of aqueously solvated molecules
Christine M Isborn, Brendan D Mar, Basile F E Curchod, et al.
Journal of the American Chemical Society
|
October 17, 2014
A remote stereochemical lever arm effect in polymer mechanochemistry
Junpeng Wang, Tatiana B Kouznetsova, Zachary S Kean, et al.
Nature Chemistry
|
June 21, 2014
Mechanically triggered heterolytic unzipping of a low-ceiling-temperature polymer
Charles E Diesendruck, Gregory I Peterson, Heather J Kulik, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
The Journal of Physical Chemistry. A
|
December 23, 2016
Depolymerization Pathways for Branching Lignin Spirodienone Units Revealed with ab Initio Steered Molecular Dynamics
Brendan D Mar, Heather J Kulik
The Journal of Physical Chemistry. A
|
July 8, 2016
Adapting DFT+U for the Chemically Motivated Correction of Minimal Basis Set Incompleteness
Heather J Kulik, Natasha Seelam, Brendan D Mar, et al.
The Journal of Physical Chemistry. A
|
May 23, 2015
Ab Initio Screening Approach for the Discovery of Lignin Polymer Breaking Pathways
Brendan D Mar, Helena W Qi, Fang Liu, et al.
The Journal of Physical Chemistry. B
|
August 23, 2013
The charge transfer problem in density functional theory calculations of aqueously solvated molecules
Christine M Isborn, Brendan D Mar, Basile F E Curchod, et al.
Journal of the American Chemical Society
|
October 17, 2014
A remote stereochemical lever arm effect in polymer mechanochemistry
Junpeng Wang, Tatiana B Kouznetsova, Zachary S Kean, et al.
Nature Chemistry
|
June 21, 2014
Mechanically triggered heterolytic unzipping of a low-ceiling-temperature polymer
Charles E Diesendruck, Gregory I Peterson, Heather J Kulik, et al.
Page
of 1