António J C Varandas (Antonio J C Varandas, A J C Varandas)

Scopus Author ID Ciência ID ORCID

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 14

Top Topics

Pseudomonas Aeruginosa

Density Functional Theory

Electron Transfer

Lymph Node Metastasis

Top Venues

The journal of physical chemistry. A

Physical chemistry chemical physics : PCCP

Journal of computational chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

D P Freitas, Fernando N N Pansini, António J C Varandas
Optimized infrared spectrum of ( H 2 O ) m : ( H C N ) n $$ {\left({H}_2O\right)}_m:{(HCN)}_n $$ mixtures. Journal of computational chemistry (2024)
António J C Varandas
Carbon-[ n ]Triangulenes and Sila-[ n ]Triangulenes: Which Are Planar? The journal of physical chemistry. A (2023)
Dandan Lu, Breno R L Galvão, António J C Varandas, Hua Guo
Quantum and semiclassical studies of nonadiabatic electronic transitions between N( 4 S) and N( 2 D) by collisions with N 2 . Physical chemistry chemical physics : PCCP (2023)
V C Mota, Pedro J S B Caridade, António J C Varandas, Breno R L Galvão
Quasiclassical Trajectory Study of the Si + SH Reaction on an Accurate Double Many-Body Expansion Potential Energy Surface. The journal of physical chemistry. A 126 (22) (2022)
António J C Varandas
From six to eight Π-electron bare rings of group-XIV elements and beyond: can planarity be deciphered from the "quasi-molecules" they embed? Physical chemistry chemical physics : PCCP 24 (14) (2022)
Srikanth Korutla, Debasish Koner, António J C Varandas, Tammineni Rajagopala Rao
Quantum and Classical Dynamics of the N(2D) + N2 Reaction on Its Ground Doublet State N3(12A″) Potential Energy Surface. The journal of physical chemistry. A 125 (25) (2021)
Fernando N N Pansini, V C Mota, António J C Varandas
Optimized Structural Data at the Complete Basis Set Limit via Successive Quadratic Minimizations. The journal of physical chemistry. A (2021)
Sandip Ghosh, Rahul Sharma, Satrajit Adhikari, António J C Varandas
Dynamical calculations of O(3P) + OH(2Π) reaction on the CHIPR potential energy surface using the fully coupled time-dependent wave-packet approach in hyperspherical coordinates. Physical chemistry chemical physics : PCCP 23 (38) (2021)
V C Mota, Breno R L Galvão, D V B Coura, António J C Varandas
Accurate Potential Energy Surface for Quartet State HN2 and Interplay of N(4S) + NH(X̃3Σ-) versus H + N2(A3Σu+) Reactions. The journal of physical chemistry. A 124 (5) (2020)
F George D Xavier, M Martínez González, António J C Varandas
Global Potential Energy Surface for HO2+ Using the CHIPR Method. The journal of physical chemistry. A 123 (8) (2019)
C M R Rocha, António J C Varandas
Accurate CHIPR Potential Energy Surface for the Lowest Triplet State of C3. The journal of physical chemistry. A 123 (38) (2019)
C M R Rocha, Jing Li, António J C Varandas
Difficulties and Virtues in Assessing the Potential Energy Surfaces of Carbon Clusters via DMBE Theory: Stationary Points of Cκ (κ = 2-10) at the Focal Point. The journal of physical chemistry. A 123 (14) (2019)
Marco Martínez González, F George D Xavier, Jing Li, Luis Alberto Montero-Cabrera, Jose Manuel García de la Vega, António J C Varandas
Role of Augmented Basis Sets and Quest for ab Initio Performance/Cost Alternative to Kohn-Sham Density Functional Theory. The journal of physical chemistry. A 124 (1) (2019)
M V Alves, C E M Gonçalves, J P Braga, V C Mota, António J C Varandas, Breno R L Galvão
Quasiclassical Study of the C(3P) + NO(X2Π) and O(3P) + CN(X2Σ+) Collisional Processes on an Accurate DMBE Potential Energy Surface. The journal of physical chemistry. A 123 (33) (2019)