E-LIB Suche - Ergebnisse für: Pouillon, Yann

1

The CECAM electronic structure library and the modular soft..:

Oliveira, Micael J. T. ; Papior, Nick ; Pouillon, Yann...
The Journal of Chemical Physics. 153 (2020) 2 - p. , 2020

Link: https://doi.org/10.1063/..

2

Siesta: Recent developments and applications:

García, Alberto ; Papior, Nick ; Akhtar, Arsalan...
The Journal of Chemical Physics. 152 (2020) 20 - p. , 2020

Link: https://doi.org/10.1063/..

3

The psml format and library for norm-conserving pseudopoten..:

García, Alberto ; Verstraete, Matthieu J. ; Pouillon, Yann.
Computer Physics Communications. 227 (2018) - p. 51-71 , 2018

Link: https://doi.org/10.1016/..

4

Bimodal supramolecular functionalization of carbon nanotube..:

Leret, Sofía ; Pouillon, Yann ; Casado, Santiago...
Chemical Science. 8 (2017) 3 - p. 1927-1935 , 2017

Link: https://doi.org/10.1039/..

5

The mechanical bond on carbon nanotubes: diameter-selective..:

Martínez-Periñán, Emiliano ; de Juan, Alberto ; Pouillon, Yann...
Nanoscale. 8 (2016) 17 - p. 9254-9264 , 2016

Link: https://doi.org/10.1039/..

6

Mechanically Interlocked Single-Wall Carbon Nanotubes:

de Juan, Alberto ; Pouillon, Yann ; Ruiz-González, Luisa...
Angewandte Chemie. 126 (2014) 21 - p. 5498-5504 , 2014

Link: https://doi.org/10.1002/..

7

Mechanically Interlocked Single‐Wall Carbon Nanotubes:

de Juan, Alberto ; Pouillon, Yann ; Ruiz‐González, Luisa...
Angewandte Chemie International Edition. 53 (2014) 21 - p. 5394-5400 , 2014

Link: https://doi.org/10.1002/..

8

The ETSF: An e-Infrastructure That Bridges Simulations and ..:

Matsuura, Anne ; Thrupp, Nicola ; Gonze, Xavier...
Computing in Science & Engineering. 14 (2012) 1 - p. 22-32 , 2012

Link: https://doi.org/10.1109/..

9

Organizing Software Growth and Distributed Development: The..:

Pouillon, Yann ; Beuken, Jean-Michel ; Deutsch, Thierry..
Computing in Science & Engineering. 13 (2011) 1 - p. 62-69 , 2011

Link: https://doi.org/10.1109/..

10

Structural properties of CuO4 and CuO5 clusters: A density ..:

Massobrio, Carlo ; Pouillon, Yann
The Journal of Chemical Physics. 119 (2003) 16 - p. 8305-8310 , 2003

Link: https://doi.org/10.1063/..

11

Neutral and anionic CuO2: an ab inito study:

Pouillon, Yann ; Massobrio, Carlo ; Celino, Massimo
Computational Materials Science. 17 (2000) 2-4 - p. 539-543 , 2000

Link: https://doi.org/10.1016/..

12

The Abinit project: Impact, environment and recent developm..:

Gonze, Xavier ; Amadon, Bernard ; Antonius, Gabriel...
boreal:225653. , 2020

Link: http://hdl.handle.net/20..

13

Siesta: Recent developments and applications:

García, Alberto ; Papior, Nick Rübner ; Akhtar, Arsalan...
https://orbit.dtu.dk/en/publications/e23c450f-8501-4816-a3c1-d03d53c0432b. , 2020

Link: https://orbit.dtu.dk/en/..

14

SIESTA: Recent developments and applications:

Garcia, Alberto ; Papior, Nick ; Akhtar, Arsalan...
info:eu-repo/semantics/altIdentifier/arxiv/2006.01270. , 2020

Link: https://hal.univ-lorrain..

15

The CECAM electronic structure library and the modular soft..:

Oliveira, Micael JT ; Papior, Nick ; Pouillon, Yann...
qt7m5193tm. , 2020

Link: https://escholarship.org..