2026-10-15T09:47:11Z https://data.mendeley.com/oai

oai:data.mendeley.com/ny25mps867.1 2020-12-22T07:24:18Z

Kostyrko, Tomasz TiO2_110x-CNT66Y.all_Δφ.ANI Mendeley Data # this file includes the 5 optimized structures of CNT(6,6) at a rutile (110) surface as described # in a paper: "A tight-binding model of a carbon nanotube interacting with TiO2 rutile (110)" # by Tomasz Kostyrko, accepted to Applied Surface Science # the optimized structures correspond to different rotations of the CNT # around its longitudinal symmetry axis # the angles of rotation are in sequence: 0,5,10,15,20 degrees # recommended viewer: jmol Surface Science DFT Method Application Surface Chemical Physics Dataset doi:10.17632/ny25mps867.1 oai:data.mendeley.com/ny25mps867.1 Creative Commons Attribution 4.0 International http://creativecommons.org/licenses/by/4.0 https://data.mendeley.com/datasets/ny25mps867 2020-12-22T07:24:18Z