Zobrazeno 1 - 10
of 2 509
pro vyhledávání: '"A. San Vicente"'
The atom-exchange and atomization dissociation dynamics for the N($^4$S) + N$_2(^1 \Sigma_{\rm g}^+)$ reaction is studied using a reproducing kernel Hilbert space (RKHS)-based, global potential energy surface (PES) at the MRCI-F12/aug-cc-pVTZ-F12 lev
Externí odkaz:
http://arxiv.org/abs/2404.18877
The reaction N(4S) + NO -> O(3P) + N2 plays a pivotal role in the conversion of atomic to molecular nitrogen in dense interstellar clouds and in the atmosphere. Here we report a joint experimental and computational investigation of the N + NO reactio
Externí odkaz:
http://arxiv.org/abs/2305.05305
Publikováno v:
J. Phys. Chem. A 126, 7971 (2022)
The prediction of product translational, vibrational, and rotational energy distributions for arbitrary initial conditions for reactive atom+diatom collisions is of considerable practical interest in atmospheric re-entry. Due to the large number of a
Externí odkaz:
http://arxiv.org/abs/2209.00379
Publikováno v:
In Solar Energy Materials and Solar Cells January 2025 279
Autor:
Goswami, Sugata, Veliz, Juan Carlos San Vicente, Upadhyay, Meenu, Bemish, Raymond J., Meuwly, Markus
The dynamics of the C($^{3}$P) + O$_{2}$($^3\Sigma_{g}^{-}$) $\rightarrow$ CO($^{1}\Sigma^{+}$)+ O($^{1}$D) reaction on its electronic ground state is investigated by using time-dependent wave packet propagation (TDWP) and quasi-classical trajectory
Externí odkaz:
http://arxiv.org/abs/2206.10958
Autor:
Sutter, Florian, Alkan, Gözde, Benameur, Nassira, Marlin, Samuel, San Vicente, Gema, Morales, Angel, Reche Navarro, Tomás Jesus, González Alves, Ana Cleia, Arcos, Lucía Martínez, Benítez, Daniel, Fernández-García, Aránzazu, Oskay, Ceyhun, Grimme, Christoph
Publikováno v:
In Solar Energy Materials and Solar Cells March 2025 281
Autor:
Junqiao Song, Angela Pacheco, Amos Alakonya, Andrea S. Cruz-Morales, Carlos Muñoz-Zavala, Jingtao Qu, Chunping Wang, Xuecai Zhang, Felix San Vicente, Thanda Dhliwayo
Publikováno v:
Crop Journal, Vol 12, Iss 2, Pp 558-568 (2024)
Maize stalk rot reduces grain yield and quality. Information about the genetics of resistance to maize stalk rot could help breeders design effective breeding strategies for the trait. Genomic prediction may be a more effective breeding strategy for
Externí odkaz:
https://doaj.org/article/5df31114a956440cb4ad59dd0f8411dc
Autor:
Pablo Veiga-San Roman, Victor Villanueva San Vicente, M. Angeles Rodriguez-Gonzalez, Pia López-Jornet
Publikováno v:
Discover Oncology, Vol 15, Iss 1, Pp 1-9 (2024)
Abstract Objective To describe overall survival (OS) and disease-free survival (DFS) in a cohort of tongue cancer patients, together with the corresponding demographic, tumor and surgical characteristics. Methods A retrospective study was made of 205
Externí odkaz:
https://doaj.org/article/7438133460184adc806e1253c0810f4c
Autor:
Patra, Sarbani, Veliz, Juan Carlos San Vicente, Koner, Debasish, Bieske, Evan J., Meuwly, Markus
The photodissociation dynamics of N$_3^+$ excited from its $^3 \Sigma_{\rm g}^{-}$ ground to the first excited singlet and triplet states is investigated. Three dimensional potential energy surfaces for the $^1$A$'$, $^1$A$''$, and $^3$A$'$ electroni
Externí odkaz:
http://arxiv.org/abs/2201.04321
Autor:
Arnold, Julian, Veliz, Juan Carlos San Vicente, Koner, Debasish, Singh, Narendra, Bemish, Raymond J., Meuwly, Markus
Publikováno v:
J. Chem. Phys. 156, 034301 (2022)
A machine learned (ML) model for predicting product state distributions from specific initial states (state-to-distribution or STD) for reactive atom-diatom collisions is presented and quantitatively tested for the N($^4$S)+O$_{2}$(X$^3 \Sigma_{\rm g
Externí odkaz:
http://arxiv.org/abs/2111.03563