E-LIB Suche - Ergebnisse für: Alcamí, Manuel

1

Theoretical Study of Structural and Electronic Trends of th..:

Pulgar, Antonio ; Valentín, Mónica ; Rauer, Clemens...
The Journal of Physical Chemistry A. 128 (2024) 29 - p. 5941-5953 , 2024

Link: https://doi.org/10.1021/..

2

Reactivity of alloxydim herbicide: force and reaction elect..:

Villaverde, Juan J. ; Sandín-España, Pilar ; Alonso-Prados, José L...
Theoretical Chemistry Accounts. 142 (2023) 10 - p. , 2023

Link: https://doi.org/10.1007/..

3

One-Electron Oxidation Potentials and Hole Delocalization i..:

Lucia-Tamudo, Jesús ; Alcamí, Manuel ; Díaz-Tendero, Sergio.
Biochemistry. 62 (2023) 22 - p. 3312-3322 , 2023

Link: https://doi.org/10.1021/..

4

Controlling the diversity of ion-induced fragmentation path..:

Barreiro-Lage, Darío ; Nicolafrancesco, Chiara ; Kočišek, Jaroslav...
Physical Chemistry Chemical Physics. 24 (2022) 2 - p. 941-954 , 2022

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

5

Hydrogenation of C24 Carbon Clusters: Structural Diversity ..:

Pla, Paula ; Dubosq, Clément ; Rapacioli, Mathias...
The Journal of Physical Chemistry A. 125 (2021) 24 - p. 5273-5288 , 2021

Link: https://doi.org/10.1021/..

6

Roadmap on dynamics of molecules and clusters in the gas ph..:

Zettergren, Henning ; Domaracka, Alicja ; Schlathölter, Thomas...
The European Physical Journal D. 75 (2021) 5 - p. , 2021

Link: https://doi.org/10.1140/..

7

A general approach to study molecular fragmentation and ene..:

Erdmann, Ewa ; Aguirre, Néstor F. ; Indrajith, Suvasthika...
Physical Chemistry Chemical Physics. 23 (2021) 3 - p. 1859-1867 , 2021

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

8

Charge and energy sharing in the fragmentation of astrophys..:

Aguirre, Néstor F. ; Díaz-Tendero, Sergio ; Hervieux, Paul-Antoine...
Theoretical Chemistry Accounts. 140 (2021) 3 - p. , 2021

Link: https://doi.org/10.1007/..

9

When is the Bell–Evans–Polanyi principle fulfilled in Diels..:

Pla, Paula ; Wang, Yang ; Alcamí, Manuel
Physical Chemistry Chemical Physics. 22 (2020) 16 - p. 8846-8852 , 2020

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

10

Foreword to the special issue on the "Electronic structure:..:

Ruiz-López, Manuel F. ; Alcamí, Manuel
Theoretical Chemistry Accounts. 139 (2020) 4 - p. , 2020

Link: https://doi.org/10.1007/..

11

Hydrogenated polycyclic aromatic hydrocarbons: isomerism an..:

Pla, Paula ; Wang, Yang ; Martín, Fernando.
Physical Chemistry Chemical Physics. 22 (2020) 38 - p. 21968-21976 , 2020

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

12

Polypeptide formation in clusters of β-alanine amino acids ..:

Rousseau, Patrick ; Piekarski, Dariusz G. ; Capron, Michael...
Nature Communications. 11 (2020) 1 - p. , 2020

Link: https://doi.org/10.1038/..

13

Theoretical Study of NO Dissociation on an Open Flat Ru(101..:

Lan, Jinggang ; Wang, Yang ; Alcamí, Manuel.
The Journal of Physical Chemistry C. 123 (2019) 9 - p. 5488-5494 , 2019

Link: https://doi.org/10.1021/..

14

Aromaticity, Coulomb repulsion, π delocalization or strain:..:

Wang, Yang ; Díaz-Tendero, Sergio ; Alcamí, Manuel.
Physical Chemistry Chemical Physics. 21 (2019) 1 - p. 124-131 , 2019

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

15

Fully versus constrained statistical fragmentation of carbo..:

Aguirre, Néstor F. ; Díaz-Tendero, Sergio ; IdBarkach, Tijani...
The Journal of Chemical Physics. 150 (2019) 14 - p. , 2019

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