PhD scholarship in Machine Learning for Quantum Chemistry of Complex Reactions - DTU Energy
Tasks
- Develop and apply quantum chemistry and machine learning methods
- Develop computational workflows for complex chemical reactions
- Generate curated reaction pathway datasets
- Identify relevant electronic degrees of freedom
- Implement automated workflow pipelines
- Represent molecular electronic structure consistently across reaction coordinates
- Use machine learning to accelerate electronic structure analysis
- Validate electronic representations against high level calculations
Perks/Benefits
- Interdisciplinary collaboration
- International research environment
- Open scientific datasets
- Reproducible workflows
Skills/Tech-stack
Data-Driven Modeling | Data-driven | Electronic structure | Electronic structure theory | Machine Learning | Molecular Modeling | Numerical Optimization | Python | Quantum Chemistry
Education
Roles
PhD researcher | Research Scientist | Researcher | Scientist
Related jobs
-
Adaptive Control | C++ | Hierarchical Control | Model Predictive | Model-Predictive ControlAcademic freedom | Conferences attendance | International collaboration | Student supervision experienceMid-level Full TimeKgs. Lyngby, Denmark2d ago
-
AI Research Resident USD 150K-150KAgent systems | Benchmarks | Constrained decoding | Dataset curation | Decision MakingCohort program | Cross-functional collaboration | Publication opportunity | Research mentorship | Startup environmentNone Full TimeNew York City3d ago
-
Computer Vision | Deep learning | Multimodal AI | PythonConference and publication support | Fully funded PhD | International research collaboration | Teaching assistant experienceEntry-level Full TimeKgs. Lyngby, Denmark4d ago
-
Machine Learning Researcher DKK 358K-390KCatBoost | Data Preparation | Machine Learning | Numerical computing | PyTorchCompany events and trips | Health insurance | Hybrid work model | Paid vacation | PensionMid-level Full TimeKøbenhavn, Denmark6d ago
-
Postdoc in Host-Microbiome Multi-omic Data Science DKK 433K-433KAutoencoders | Deep learning | Explainable AI | Graph Neural Networks | High PerformanceEntry-level Full TimeOdense M, Danmark9d ago
-
Postdoc in Microbiome Bioinformatics Workflows DKK 438K-438KBioinformatics | CWL | High Performance | High-Performance Computing | MetabolomicsMid-level Full TimeOdense M, Danmark9d ago
-
Data Scientist DKK 570K-838KCI/CD | Cloud Computing | Cloud platform | Data Preparation | ExperimentationMid-level Full TimeSmørum, DK, 276515d ago
-
Artificial Intelligence | Cyber-Physical Systems | Distributed Systems | Edge Computing | Embedded SystemsAcademic and industry collaboration | International research environment | Relocation support | State-of-the-art facilitiesEntry-level Full TimeKgs. Lyngby, Denmark16d ago
-
Media Decision Science Manager DKK 491K-720KApache Spark | Automation | Data Governance | Data Modeling | Data QualityColleague discount | Family care leave | Headspace app access | Hybrid work flexibility | Life and disability insuranceMid-level Full TimeCopenhagen Hub - Løvstræde, Denmark19d ago
-
Bioinformatics | Computational Biology | Data Analysis | Data integration | Machine LearningAcademic freedom | Collegial respect | International research environmentEntry-level Full TimeKgs. Lyngby, Denmark25d ago
-
Quantitative Researcher - Equity Statistical Arbitrage DKK 541K-576KBenchmarking | C# | C++ | Calibration | CatBoost30 days vacation | Company events | Health insurance | Hybrid work model | PensionMid-level Full TimeKøbenhavn, Denmark26d ago
-
Computational Political Communication Postdoc position(s) at The Digital Democracy Centre DKK 10000KBig Data | Big data analytics | Data Analysis | Data analytics | Experimental DesignDanish language training | Teaching opportunitiesEntry-level Full TimeOdense M, Denmark29d ago
-
3D Scene | 3D Scene Understanding | C++ | Cloud processing | Computer VisionEntry-level Full TimeKgs. Lyngby, Denmark1mo ago
-
AI Governance | Artificial Intelligence | Change Management | Cloud Computing | Data GovernanceSenior-level Full TimeBillund, Denmark1mo ago
-
Cyber-Physical Systems | Distributed Computing | Edge Computing | Embedded Systems | Generative AIAccess to state-of-the-art facilities | International research environment | Opportunities to build teaching portfolio | Professional network building | Support with proposal writingEntry-level Full TimeKgs. Lyngby, Denmark1mo ago
-
PhD scholarship in Causal-informed Machine Learning Methods for Climate Modelling - DTU Compute DKK 386K-386KCausal Inference | Diffusion Models | Flax | Graph Modeling | HPCFully funded PhD scholarship | International research environmentEntry-level Full TimeKgs. Lyngby, Denmark1mo ago
-
PhD position in detector development for the next generation of cryogenic dark-matter axion experiments at SDU in Odense DKK 433K-433KCERN | Cryogenics | Data Analysis | Data acquisition | Particle physicsAccess to experimental facilities | Mobility to CERN | Shift workEntry-level Full TimeOdense M, Denmark1mo ago