Published September 4, 2017 | Version v1
Project deliverable Open

Quantum dynamics E-CAM modules I

  • 1. École polytechnique fédérale de Lausanne
  • 2. University College London
  • 3. Université de Saclay
  • 4. Maison de la Simulation

Description

In this report for Deliverable 3.1 of E-CAM, 6 software modules in quantum dynamics,which are related to the Extended
Software Development Workshop (ESDW) held by E-CAM at Maison de la Simulation, Saclay, in July 2016, are presented.
The 6 modules are respectively named: SodLib, ChebLib, PhysConst, PotLib, AuXMod, ClassMC. They include codes
for exact integrators of quantum dynamics for low dimensional systems, potentials, calculation of quantum time
correlation functions, and their documentation. In this report, a short description is written for each module, followed
by a link to the respective Merge-Request on the GitLab service of E-CAM. These merge requests contain detailed
information about the code development, testing and documentation of the modules.

Files

Deliverable_3.1.pdf

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Additional details

Funding

European Commission
E-CAM - An e-infrastructure for software, training and consultancy in simulation and modelling 676531