Project Eocoe

Organisation/Company: Consiglio Nazionale delle Ricerche - Istituto dei Materiali Nanostrutturati
Research Field: Chemistry
Researcher Profile: Recognised Researcher (R2), Leading Researcher (R4), First Stage Researcher (R1), Established Researcher (R3)
Country: Italy
Application Deadline: 15 Feb 2025 - 23:59 (UTC)
Type of Contract: To be defined
Job Status: Not Applicable
Is the job funded through the EU Research Framework Programme? Not funded by a EU programme
Is the Job related to staff position within a Research Infrastructure? No
Offer DescriptionThe main work consists in extending the libNEGF code with the aim of distributing the spatial domain of Green's Functions and achieving massive parallelization of the code.
The objective is to validate the DFTB+libNEGF code applied to TMDCs such as MoS2 and WS2, in particular the interaction of carriers with phonons and photons.
In collaboration with a PhD student, it is necessary to extend libNEGF to take into account the excitonic interaction by modeling the shielded Coulomb interaction, W(q), obtained from GW calculations.
The code will be applied to study photovoltaic materials such as bilayers of MoS2/WS2.
Eligibility of FellowsCountry/ies of residence: EUROPE
Nationality/ies: Not specified

#J-18808-Ljbffr