E-LIB Suche - Ergebnisse für: Viegas, Luís P.

1

With a little help from our (AI) friend: A general transiti..:

Viegas, Luís P. ; Galvão, Breno R.L.
Atmospheric Environment. 328 (2024) - p. 120515 , 2024

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

2

A Multiconformational Transition State Theory Approach to O..:

Viegas, Luís P.
ChemPhysChem. , 2023

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

3

A computer-based solution to the oxidation kinetics of fluo..:

Viegas, Luís P. ; Jensen, Frank
Environmental Science: Atmospheres. 3 (2023) 5 - p. 855-871 , 2023

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

4

Gas-phase OH-oxidation of 2-butanethiol: Multiconformer tra..:

Viegas, Luís P.
Chemical Physics Letters. 803 (2022) - p. 139829 , 2022

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

5

Multiconformer transition state theory rate constant and br..:

Viegas, Luís P.
Journal of Physical Organic Chemistry. 36 (2022) 3 - p. , 2022

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

6

Inducing molecular reactions by selective vibrational excit..:

M. Nunes, Cláudio ; Pereira, Nelson A. M. ; Viegas, Luís P...
Chemical Communications. 57 (2021) 75 - p. 9570-9573 , 2021

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

7

Switching on H-Tunneling through Conformational Control:

Roque, José P. L. ; Nunes, Cláudio M. ; Viegas, Luís P....
Journal of the American Chemical Society. 143 (2021) 22 - p. 8266-8271 , 2021

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

8

Spin-forbidden heavy-atom tunneling in the ring-closure of ..:

Viegas, Luís P. ; M. Nunes, Cláudio ; Fausto, Rui
Physical Chemistry Chemical Physics. 23 (2021) 10 - p. 5797-5803 , 2021

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

9

Simplified Protocol for the Calculation of Multiconformer T..:

Viegas, Luís P.
The Journal of Physical Chemistry A. 125 (2021) 21 - p. 4499-4512 , 2021

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

10

Reliability of semiempirical and DFTB methods for the globa..:

Galvão, Breno R. L. ; Viegas, Luís P. ; Salahub, Dennis R..
Journal of Molecular Modeling. 26 (2020) 11 - p. , 2020

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

11

Glucuronidation of Methylated Quercetin Derivatives: Chemic..:

Docampo-Palacios, Maite L. ; Alvarez-Hernández, Anislay ; Adiji, Olubu...
Journal of Agricultural and Food Chemistry. 68 (2020) 50 - p. 14790-14807 , 2020

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

12

Heavy‐Atom Tunneling Through Crossing Potential Energy Surf..:

Nunes, Cláudio M. ; Viegas, Luís P. ; Wood, Samuel A....
Angewandte Chemie. 132 (2020) 40 - p. 17775-17780 , 2020

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

13

Reactivity of α,ω-Dihydrofluoropolyethers toward OH Predict..:

Viegas, Luı́s P. ; Jensen, Frank
The Journal of Physical Chemistry A. 124 (2020) 17 - p. 3460-3470 , 2020

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

14

Heavy‐Atom Tunneling Through Crossing Potential Energy Surf..:

Nunes, Cláudio M. ; Viegas, Luís P. ; Wood, Samuel A....
Angewandte Chemie International Edition. 59 (2020) 40 - p. 17622-17627 , 2020

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

15

What Electronic Structure Method Can Be Used in the Global ..:

Galvão, Breno R. L. ; Viegas, Luís P.
The Journal of Physical Chemistry A. 123 (2019) 48 - p. 10454-10462 , 2019

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