@inproceedings{bordat:hal-00763462, TITLE = {{Parallel TDDFT/DFT/MD code for the simulation of organic-inorganic hybrid materials}}, AUTHOR = {Bordat, Patrice and Coulaud, Olivier and Brown, Ross and Baraille, Isabelle}, URL = {https://inria.hal.science/hal-00763462}, NOTE = {30 pages}, BOOKTITLE = {{CCP5 annual meeting 2012}}, ADDRESS = {Huddersfield, United Kingdom}, YEAR = {2012}, MONTH = Sep, KEYWORDS = {molecular dynamics simulation ; DFT ; TDDFT ; solvatochromism ; indigo ; solutions}, HAL_ID = {hal-00763462}, HAL_VERSION = {v1}, }