QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: krahil on September 19, 2017, 22:50

Title: TiO2 nanotube
Post by: krahil on September 19, 2017, 22:50

Hello Sir,
How can we form a nanotube of TiO2(titania)?
In a tutorial video for a tube of MoS2, they have considered 2,1,0 values for A' in super cell for converting the lattice to orthorhombic. I tried it for the TiO2 but the resultant structure is not satisfactory.

Title: Re: TiO2 nanotube
Post by: Ulrik G. Vej-Hansen on September 19, 2017, 22:59

Please search before posting a message - this has already been discussed before: https://quantumwise.com/forum/index.php?topic=4023.0