Theoretical Elastic Constants of Tobermorite Enhanced with Reduced Graphene Oxide through Hydroxyl vs Epoxy Functionalization: A First-Principles Study-Reference-Cited by-同舟云学术

Theoretical Elastic Constants of Tobermorite Enhanced with Reduced Graphene Oxide through Hydroxyl vs Epoxy Functionalization: A First-Principles Study

Published:2023-09-05 Issue:36 Volume:127 Page:18117-18126
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Izadifar Mohammadreza¹^ORCID,Dolado Jorge S.²³^ORCID,Thissen Peter⁴^ORCID,Ukrainczyk Neven¹^ORCID,Koenders Eduardus¹^ORCID,Ayuela Andres²³

Affiliation:

1. Institute of Construction and Building Materials, Technical University of Darmstadt, Franziska-Braun-Straße 3, 64287 Darmstadt, Germany

2. Centro de Física de Materiales-Materials Physics Center, Centro Mixto CSIC-UPV/EHU, Paseo Manuel Lardizabal 5, 20018 San Sebastián, Spain

3. Donostia International Physics Center, Paseo Manuel Lardizabal 3, 20018 San Sebastián, Spain

4. Karlsruher Institut für Technologie (KIT), Institut für Massivbau und Baustofftechnologie (IMB), Abteilung IV Modellierung und Simulation Gotthard-Franz-Straße 3, 76131 Karlsruhe, Germany

Funder

European Commission

Ministerio de Ciencia e Innovación

Deutsche Forschungsgemeinschaft

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c03893

Reference65 articles.

1. A Molecular Dynamic Study of Cementitious Calcium Silicate Hydrate (C?S?H) Gels