mathematik > pn3 | PUMA

bookmarks (hide)
display
all
bookmarks only
bookmarks per page
5
10
20
50
100
sort by
added at
title
RSS
BibTeX
XML

No matching posts.

⟨⟨
⟨
⟩
⟩⟩

publications (hide)2
display
all
publications only
publications per page
5
10
20
50
100
sort by
added at
title
author
publication date
entry type
help for advanced sorting...
BibTeX
CSV
RDF
RSS
more...

6A Quasi Time-Reversible Scheme Based on Density Matrix Extrapolation on the Grassmann Manifold for Born–Oppenheimer Molecular Dynamics
F. Pes, É. Polack, P. Mazzeo, G. Dusson, B. Stamm, and F. Lipparini. The Journal of Physical Chemistry Letters, (October 2023)
2 years ago by @mathematik
show all tags
myown
pn3
peerReviewed
update
nmh
EXC2075
ians
myownpn3peerReviewedupdatenmhEXC2075ians
copydeleteadd this publication to your clipboard
2Gaussian Process Regression for Minimum Energy Path Optimization and Transition State Search
A. Denzel, B. Haasdonk, and J. Kästner. J. Phys. Chem. A, 123 (44): 9600--9611 (2019)
4 years ago by @mathematik
show all tags
EXC2075
anm
denzel
from:britsteiner
haasdonk
ians
imported
kaestner
pn3
simtech
EXC2075anmdenzelfrom:britsteinerhaasdonkiansimportedkaestnerpn3simtech
copydeleteadd this publication to your clipboard

⟨⟨
⟨
1
⟩
⟩⟩