<?xml version="1.0" encoding="UTF-8"?><xml><records><record><source-app name="Biblio" version="7.x">Drupal-Biblio</source-app><ref-type>17</ref-type><contributors><authors><author><style face="normal" font="default" size="100%">Tassi, M.</style></author><author><style face="normal" font="default" size="100%">Morphis, A.</style></author><author><style face="normal" font="default" size="100%">Lambropoulos, K.</style></author><author><style face="normal" font="default" size="100%">Simserides, C.</style></author></authors><secondary-authors><author><style face="normal" font="default" size="100%">Bernardo Spagnolo</style></author></secondary-authors></contributors><titles><title><style face="normal" font="default" size="100%">RT-TDDFT study of hole oscillations in B-DNA monomers and dimers</style></title><secondary-title><style face="normal" font="default" size="100%">Cogent Physics</style></secondary-title></titles><dates><year><style  face="normal" font="default" size="100%">2017</style></year></dates><urls><web-urls><url><style face="normal" font="default" size="100%">https://doi.org/10.1080/23311940.2017.1361077</style></url></web-urls></urls><number><style face="normal" font="default" size="100%">1</style></number><publisher><style face="normal" font="default" size="100%">Cogent OA</style></publisher><volume><style face="normal" font="default" size="100%">4</style></volume><pages><style face="normal" font="default" size="100%">1361077</style></pages><language><style face="normal" font="default" size="100%">eng</style></language><abstract><style face="normal" font="default" size="100%">AbstractWe employ Real-Time Time-Dependent Density Functional Theory to study hole oscillations within a B-DNA monomer (one base pair) or dimer (two base pairs). Placing the hole initially at any of the bases which make up a base pair, results in THz oscillations, albeit of negligible amplitude. Placing the hole initially at any of the base pairs which make up a dimer is more interesting: For dimers made of identical monomers, we predict oscillations with frequencies in the range f≈ 20–40 THz, with a maximum transfer percentage close to 1. For dimers made of different monomers, f≈ 80–400 THz, but with very small or small maximum transfer percentage. We compare our results with those obtained recently via our Tight-Binding approaches and find that they are in good agreement.</style></abstract></record></records></xml>