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The Journal of Chemical Physics|March 2, 2026
Quantifying electron correlation effects in ethanol decomposition pathwaysL Cândido, G-Q Hai
Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 11, 2011
Two-dimensional electron states bound to an off-plane donor in a magnetic fieldA Bruno-Alfonso, L Cândido, G-Q Hai
The Journal of Chemical Physics|June 8, 2023
Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte CarloB G A Brito, G-Q Hai, L Cândido
The Journal of Chemical Physics|November 12, 2025
Stabilization mechanisms in the Li3+ cluster: A quantum Monte Carlo study of electron delocalization and correlationB G A Brito, L Cândido, G-Q Hai
The Journal of Chemical Physics|July 6, 2019
Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clustersB G A Brito, G-Q Hai, L Cândido
Journal of Molecular Modeling|June 25, 2021
Probing the ground-state structural transition in small lithium clusters by quantum Monte Carlo simulationsB G A Brito, E L Verde, G-Q Hai, et al.
Physical Chemistry Chemical Physics : PCCP|January 18, 2022
Electron correlation effects in boron clusters BQn (for <i>Q</i> = -1, 0, 1 and <i>n</i> ≤ 13) based on quantum Monte Carlo simulationsE M Isaac Moreira, B G A Brito, G-Q Hai, et al.
Physical Chemistry Chemical Physics : PCCP|April 28, 2021
Quantifying electron-correlation effects in small coinage-metal clusters <i>via ab initio</i> calculationsV G de Pina, B G A Brito, G-Q Hai, et al.
The Journal of Chemical Physics|December 12, 2018
Quantum Monte Carlo study of the electron binding energies and aromaticity of small neutral and charged boron clustersE M Isaac Moreira, B G A Brito, J Higino Damasceno, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 5, 2014
Metastable electron-pair states in a two-dimensional crystalG-Q Hai, L K Castelano
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