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1 Ergebnisse
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Theoretical Prediction of Structures, Vibrational Circular ..:
Carlos Emiliano Buelna-García
;
Eduardo Robles-Chaparro
;
Tristan Parra-Arellano
...
Materials Chemistry. , 2021
Link:
https://doi.org/10.3390/molecules26133953
RT Journal T1
Theoretical Prediction of Structures, Vibrational Circular Dichroism, and Infrared Spectra of Chiral Be4B8 Cluster at Different Temperatures
UL https://suche.suub.uni-bremen.de/peid=base-ftmdpi:oai:mdpi.com:_1420-3049_26_13_3953_&Exemplar=1&LAN=DE A1 Carlos Emiliano Buelna-García A1 Eduardo Robles-Chaparro A1 Tristan Parra-Arellano A1 Jesus Manuel Quiroz-Castillo A1 Teresa del-Castillo-Castro A1 Gerardo Martínez-Guajardo A1 Cesar Castillo-Quevedo A1 Aned de-León-Flores A1 Gilberto Anzueto-Sánchez A1 Martha Fabiola Martin-del-Campo-Solis A1 Ana Maria Mendoza-Wilson A1 Alejandro Vásquez-Espinal A1 Jose Luis Cabellos PB Multidisciplinary Digital Publishing Institute YR 2021 K1 global minimum K1 beryllium–boron cluster K1 Be 4 B 8 K1 density functional theory K1 temperature K1 Boltzmann factors K1 Gibbs free energy K1 entropy K1 enthalpy K1 thermochemistry K1 vibrational circular dichroism K1 IR spectra K1 quantum statistical mechanics K1 genetic algorithm K1 adaptive natural density partitioning method K1 nanothermodynamics JF Materials Chemistry LK http://dx.doi.org/https://doi.org/10.3390/molecules26133953 DO https://doi.org/10.3390/molecules26133953 SF ELIB - SuUB Bremen
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