Published August 2, 2019
| Version v1
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A Topological Data Analysis Perspective on Non-Covalent Interactions in Relativistic Calculations - supplementary information
- 1. Centre of New Technologies, University of Warsaw, S. Banacha 2c 02-097 Warsaw, Poland
- 2. Université de Lille, CNRS, UMR 8523 - PhLAM - Physique des Lasers, Atomes et Molécules, F-59000 Lille, France
- 3. Sorbonne Université, CNRS, Laboratoire d'Informatique de Paris 6, LIP6, F-75005 Paris, France
Description
This repository contains the supplementary data to the following publication:
"A Topological Data Analysis Perspective on Non-Covalent Interactions in Relativistic Calculations", by the same authors.
Notes
The financial support (additional to the one mentioned under "Grants" field below) from:
* the Polish National Science Centre (NCN): grant number 2016/23/D/ST4/03217,
* the Labex CaPPA: contract ANR-11-LABX-0005-01,
* I-SITE ULNE project OVERSEE: contract ANR-16-IDEX-0004,
* CPER CLIMIBIO (European Regional Development Fund, Hauts de France council, French Ministry of Higher Education and Research),
* the French national supercomputing facilities: grant DARI A0050801859
is acknowledged.
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esi.pdf
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Additional details
Related works
- Is supplement to
- Journal article: 10.1002/qua.26133 (DOI)
- Preprint: arXiv:1908.00911v2 (arXiv)