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Johannes Hachmann

  • Dr.
  • Assistant Professor
  • University at Buffalo - The State University of New York
  • 9h-indexImpact measure calculated using publication and citation counts. Updated daily.
  • 851CitationsNumber of citations received by Johannes's publications. Updated daily.

Other IDs

Research interests

Rational DesignMachine LearningData MiningMaterials InformaticsComputational Materials ScienceCondensed Matter PhysicsMolecular Quantum MechanicsComputational ChemistryQuantum ChemistryTheoretical ChemistryElectronic Structure Theory

About

My work combines quantum chemical modeling with virtual high-throughput and Big Data techniques as well as data mining ideas from machine learning and informatics. This approach facilitates an understanding of structure-property relationships in order to development rational design capabilities. Particular applications are the areas of catalysis and advanced materials.

Co-authors (38)

Publications (5)

  • Revisiting the polytopal rearrangements in penta-coordinate d 7 -metallocomplexes: modified Berry pseudorotation, octahedral switch, and butterfly isomerization

    • Asatryan R
    • Ruckenstein E
    • Hachmann J
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  • The Harvard organic photovoltaic dataset

    • Lopez S
    • Pyzer-Knapp E
    • Simm G
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  • Lead candidates for high-performance organic photovoltaics from high-throughput quantum chemistry – the Harvard Clean Energy Project

    • Hachmann J
    • Olivares-Amaya R
    • Jinich A
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  • Organic Photovoltaics

    • Amador-Bedolla C
    • Olivares-Amaya R
    • Hachmann J
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  • Accelerated computational discovery of high-performance materials for organic photovoltaics by means of cheminformatics

    • Olivares-Amaya R
    • Amador-Bedolla C
    • Hachmann J
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Professional experience

Assistant Professor

University at Buffalo, The State University of New York

January 2014 - Present

Postdoctoral Research Fellow

Harvard University, Department of Chemistry and Chemical Biology

November 2009 - January 2014(4 years)

Graduate Research Assistent

Cornell University

August 2004 - October 2009(5 years)

Education history

M.Sc., Ph.D.

Cornell University, Department of Chemistry and Chemical Biology

August 2004 - February 2010(6 years)

Dipl.-Chem.

Friedrich-Schiller-Universität Jena, School of Chemical and Earth Sciences

October 1999 - November 2004(5 years)

University of Cambridge, Cambridge University Centre for Computational Chemistry

October 2003 - July 2004(9 months)