[DFTB-Plus-User] Halogen bonding correction on DFTB+

[Francisco Adasme]

Dear DFTB+ members,

I'm interested in optimizing some halogen-bonded dimers using DFTB3 as
parameterized in [J. Chem. Theory Comput., 2015, 11 (1), pp 332–342
<http://pubs.acs.org/doi/abs/10.1021/ct5009137>]. In the article, the
authors stated that the X correction was implemented in a modified version
of DFTB+, but there is no such version available in the webpage nor a
mention about it in the manual. So I'm wondering where I can find the
X-corrected code or if there is an undocumented option to enable it in the
current code.

Best regards,
Francisco.
-- 
Francisco Adasme Carreño
Bioinformatics Engineer, PhD
Center for Bioinformatics and Molecular Simulations, CBSM
Universidad de Talca
Av. Lircay S/N, Talca, Chile
T: (+56) 71 2 201 798
E: francisco.adasme at gmail.com or fadasmec at utalca.cl
URL: http://about.me/franciscoadasme,
https://www.researchgate.net/profile/Francisco_Adasme
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