Image de couverture de livre

The Interoperability Challenge in DFT Workflows Across Implementations

Fuente: arXiv

Enregistré dans:

Détails bibliographiques
Auteurs principaux:	Steensen, S. K., Thakur, T. S., Dillenz, M., Carlsson, J. M., Rego, C. R. C., Flores, E., Hajiyani, H., Hanke, F., Lastra, J. M. G., Wenzel, W., Marzari, N., Vegge, T., Pizzi, G., Castelli, I. E.
Format:	Preprint
Publié:	2025
Sujets:	Materials Science
Accès en ligne:	Acceder al recurso
Tags:	Ajouter un tag Pas de tags, Soyez le premier à ajouter un tag!

Documents similaires

The Interoperability Challenge in DFT Workflows Across Implementations
par: Simon K. Steensen, et autres
Publié: (2026)

Implementing a Scalable, Redeployable and Multitiered Repository for FAIR and Secure Scientific Data Sharing: The BIG-MAP Archive
par: Granata, Valeria, et autres
Publié: (2025)

The Necessity of Dynamic Workflow Managers for Advancing Self‐Driving Labs and Optimizers
par: Simon K. Steensen, et autres
Publié: (2025)

Autonomous Battery Optimization by Deploying Distributed Experiments and Simulations
par: Monika Vogler, et autres
Publié: (2024)

Autonomous Battery Optimization by Deploying Distributed Experiments and Simulations (Adv. Energy Mater. 46/2024)
par: Monika Vogler, et autres
Publié: (2024)

Casual Democracy
par: Steensen, Steen
Publié: (2025)

A Core Ontology for Particle Accelerators: Interoperable Data and Workflows Across Facilities
par: Tennant, Chris
Publié: (2025)

El uso de insecticidas para el control de Haematobia irritans (L.) (DIPTERA: MUSCIDAE) en la Argentina
par: M.E Castelli
Publié: (2006)

What is Digital Journalism Studies?
par: Steensen, Steen, et autres
Publié: (2025)

Novel fast Li-ion conductors for solid-state electrolytes from first-principles
par: Thakur, Tushar Singh, et autres
Publié: (2026)

Orbital-resolved DFT+U for molecules and solids
par: Macke, Eric, et autres
Publié: (2023)

Interoperability: The Standards Challenge for the 1990s.
par: Lynch, Clifford
Publié: (1993)

Carrier mobilities and electron-phonon interactions beyond DFT
par: Poliukhin, Aleksandr, et autres
Publié: (2025)

An Implementation of DADM Using Semantic Interoperability and Visualization
par: Thomas Hagedorn, et autres
Publié: (2025)

Pronósticos en los negocios / John E. Hanke, Dean W. Wichern ; Trad. Astrid Mues Zepeda, Ekaterina Guerrero Ushakova
par: Hanke, John E
Publié: (2006)

Pronósticos en los negocios / John E. Hanke, Dean W. Wichern
par: Hanke, John E
Publié: (2006)

A sulfonitride transparent conductive thin film with ultra-high refractive index
par: Bertin, Eugène, et autres
Publié: (2026)

Fisheries in the Southwest Indian Ocean: Trends and Governance Challenges
par: Kimani, E.N., et autres
Publié: (2009)

Robust Wannierization including magnetization and spin-orbit coupling via projectability disentanglement
par: Jiang, Yuhao, et autres
Publié: (2025)

Dinitrosyl Iron Complexes (DNICs)—DFT Calculations of the Structure and Reactions With Thiol Ligands and Water Molecules
par: A. M. Genaev, et autres
Publié: (2025)

Aiming for AI Interoperability: Challenges and Opportunities
par: Faveri, Benjamin, et autres
Publié: (2026)

Collaborative Agentic AI Needs Interoperability Across Ecosystems
par: Sharma, Rishi, et autres
Publié: (2025)

Sensing-based Robustness Challenges in Agricultural Robotic Harvesting
par: Beldek, C., et autres
Publié: (2025)

ExaWorks Software Development Kit: A Robust and Scalable Collection of Interoperable Workflow Technologies
par: Turilli, Matteo, et autres
Publié: (2024)

AgentCo-op: Retrieval-Based Synthesis of Interoperable Multi-Agent Workflows
par: Shen, Shuaike, et autres
Publié: (2026)

Public versus Less-Public News Engagement on Facebook: Patterns Across Bias and Reliability
par: Mohammadinodooshan, Alireza, et autres
Publié: (2023)

Regulatory Problems in Infancy: Prevalence and Association With Early Neurodevelopmental and Medical Conditions in Toddlers
par: E. Carlsson, et autres
Publié: (2025)

Increased Incidence of Type 1 Diabetes and Co‐Existing Thyroid Autoimmunity During the COVID ‐19 Pandemic in Sweden
par: J. Anderberg, et autres
Publié: (2025)

Formal Definition and Implementation of Reproducibility Tenets for Computational Workflows
par: Pritchard, Nicholas J., et autres
Publié: (2024)

Pressure tuning of putative quantum criticality on YbV6Sn6
par: Sabino, P. C., et autres
Publié: (2025)

Interoperable Provenance Authentication of Broadcast Media using Open Standards-based Metadata, Watermarking and Cryptography
par: Simmons, John C., et autres
Publié: (2024)

Interoperable Workflows by Exchanging Grid-Based Data between Quantum-Chemical Program Packages
par: Focke, Kevin, et autres
Publié: (2024)

Spezi Data Pipeline: Streamlining FHIR-based Interoperable Digital Health Data Workflows
par: Bikia, Vasiliki, et autres
Publié: (2025)

Modelling of Soil Multifunctionality Across Europe
par: Alexandre M. J.‐C. Wadoux, et autres
Publié: (2025)

Towards a Theory of Interoperability of Software Systems
par: Diana M. Torres
Publié: (2023)

KILLING FEDERALISM FROM ABOVE: CONSTITUTIONAL CULTURE, THE ITALIAN FOUNDING, AND THE SEEDS OF CONTEMPORARY INSTABILITY
par: Nikolai G. Wenzel
Publié: (2015)

MATCHING CONSTITUTIONAL CULTURE AND PARCHMENT: POST-COLONIAL CONSTITUTIONAL ADOPTION IN MEXICO AND ARGENTINA
par: Nikolai G. Wenzel
Publié: (2010)

From Revolution to Evolution: The Transformation of the Bibliotheque Nationale into the Bibliotheque Nationale de France, through the Lens of Popular and Professional Reports.
par: Wenzel, Sarah G.
Publié: (1999)

The "I" in FAIR: Translating from Interoperability in Principle to Interoperation in Practice
par: Morris, Evan, et autres
Publié: (2026)

Síndrome cardiometabólico. Inflamación, tejido adiposo, resistencia a la insulina y aterogénesis -se expande el rompecabezas
par: Guido Lastra G.
Publié: (2005)