ASCOT: A web tool for the digital construction of energy minimized Ag, CuO, TiO2 spherical nanoparticles and calculation of their atomistic descriptors

ASCOT: A web tool for the digital construction of energy minimized Ag, CuO, TiO2 spherical nanoparticles and calculation of their atomistic descriptors

ASCOT (an acronym derived from Ag-Silver, Copper Oxide, Titanium Oxide) is a user-friendly web tool for digital construction of electrically neutral, energy-minimized spherical nanoparticles (NPs) of Ag, CuO, and TiO2 (both Anatase and Rutile forms) in vacuum, integrated into the Enalos Cloud Platfo...

Full description

Bibliographic Details
Main Authors: Panagiotis D. Kolokathis, Evangelos Voyiatzis, Nikolaos K. Sidiropoulos, Andreas Tsoumanis, Georgia Melagraki, Kaido Tämm, Iseult Lynch, Antreas Afantitis
Format: Article
Language:English
Published: Elsevier 2024-12-01
Series:Computational and Structural Biotechnology Journal
Subjects:
Ag
CuO
TiO2
Tenorite
Anatase
Rutile
Online Access:http://www.sciencedirect.com/science/article/pii/S2001037024000643

Internet

http://www.sciencedirect.com/science/article/pii/S2001037024000643

Similar Items