Eduardo Robles-Chaparro

collaborators

2 papers

cond-mat.mtrl-sci2021

Relative abundances and enantiomerization energy of the chiral Cu $_{13}$ cluster at finite temperature

Cesar Castillo-Quevedo, Carlos Emiliano Buelna-Garcia, Edgar Paredes-Sotelo +8

This study reports the lowest energy structure of bare Cu $_{13}$ nanoclusters as a pair of enantiomers for temperatures ranging from 20 to 1200 K. Moreover, we compute the enantiom…

cond-mat.mtrl-sci2021

Exploration of potential and free energy surfaces of the neutral Be $_{4}$ B $_{8}$ chiral clusters and their stabilities at finite temperatures

Carlos Emiliano Buelna-Garcia, Cesar Castillo-Quevedo, Eduardo Robles-Chaparro +10

The lowest-energy structure, distribution of isomers, and their molecular properties depend significantly on the geometry and temperature. The total energy computations under DFT m…

Relative abundances and enantiomerization energy of the chiral Cu13​ cluster at finite temperature

Exploration of potential and free energy surfaces of the neutral Be4​B8​ chiral clusters and their stabilities at finite temperatures

Relative abundances and enantiomerization energy of the chiral Cu $_{13}$ cluster at finite temperature

Exploration of potential and free energy surfaces of the neutral Be $_{4}$ B $_{8}$ chiral clusters and their stabilities at finite temperatures