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Dopyqo: Many-body analysis on top of DFT calculations

Schultheis, Erik and Breuil, Gabriel and Rehn, Alexander (2025) Dopyqo: Many-body analysis on top of DFT calculations. Munich Quantum Software Forum 2025, 2025-10-20 - 2025-10-21, München.

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Item URL in elib:https://elib.dlr.de/218100/
Document Type:Conference or Workshop Item (Poster)
Title:Dopyqo: Many-body analysis on top of DFT calculations
Authors:
AuthorsInstitution or Email of AuthorsAuthor's ORCID iDORCID Put Code
Schultheis, ErikErik.Schultheis (at) dlr.dehttps://orcid.org/0009-0007-4728-7124UNSPECIFIED
Breuil, Gabrielgabriel.breuil (at) dlr.dehttps://orcid.org/0000-0001-9753-9384UNSPECIFIED
Rehn, Alexanderalexander.rehn (at) dlr.dehttps://orcid.org/0000-0002-9058-4569UNSPECIFIED
Date:20 October 2025
Refereed publication:No
Open Access:No
Gold Open Access:No
In SCOPUS:No
In ISI Web of Science:No
Status:Published
Keywords:Dopyqo, DFT, Material Simulation, VQE, Bader charges
Event Title:Munich Quantum Software Forum 2025
Event Location:München
Event Type:international Conference
Event Start Date:20 October 2025
Event End Date:21 October 2025
HGF - Research field:other
HGF - Program:other
HGF - Program Themes:other
DLR - Research area:Quantum Computing Initiative
DLR - Program:QC AW - Applications
DLR - Research theme (Project):QC - QuantiCoM
Location: Köln-Porz
Institutes and Institutions:Institute of Materials Research > Metallic and Hybrid Materials
Deposited By: Schultheis, Erik
Deposited On:19 Nov 2025 11:16
Last Modified:10 Mar 2026 10:15

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