All Presentations
Here is the complete list of all of Johannes’ presentations:
- TBD, Conference on Electronics Materials and Applications 2014 (EMA 2014), Symposium on ‘Computational Design of Electronic Materials’, Orlando (FL), Jan 2014. (invited talk)
- From high-throughput quantum chemistry to the rational design of organic semiconductors – a big data and materials informatics approach, CECAM Workshop on Structure-property relationships of molecular precursors to organic electronics, Lausanne (Switzerland), Oct 2013. (invited talk)
- TBD, 49th Symposium on Theoretical Chemistry ‘Bridging Scales in Theoretical Chemistry’, Erlangen (Germany), Sep 2013. (talk)
- The Harvard Clean Energy Project: High-throughput screening and design of organic photovoltaic materials via automated, first-principles quantum chemistry on the IBM World Community Grid, 246th ACS National Meeting, Division of Physical Chemistry Symposium on Physical Chemistry of Solar Energy Conversion, Indianapolis (IN), Sep 2013. (invited talk)
- High-throughput and big data techniques in computational materials science, 246th ACS National Meeting, Division of Computers in Chemistry Symposium on Chemical Mechanisms in Advanced Materials, Indianapolis (IN), Sep 2013. (invited talk)
- Harvard Clean Energy Project: From big data and cheminformatics to the rational design of molecular OPV materials, 246th ACS National Meeting, Division of Chemical Information, Indianapolis (IN), Sep 2013. (poster)
- Rational design of semiconductors for organic photovoltaics via high-throughput quantum chemistry and materials informatics, Department Seminar, School of Chemistry, University of Edinburgh, Edinburgh (Scotland), May 2013. (invited talk)
- Rationales Design von Halbleitern für organische Solarzellen durch high-throughput Quantenchemie und Materialinformatik, Theoretical Chemistry Colloquium, Institute of Physical and Theoretical Chemistry, Braunschweig University of Technology, Braunschweig (Germany), May 2013. (invited talk)
- The Harvard Clean Energy Project: Computational high-throughput screening of OPV materials on the IBM World Community Grid, Department Seminar, Department of Chemical and Biological Engineering, University at Buffalo, SUNY, Amherst (NY), Mar 2013. (invited talk)
- Automated, high-throughput quantum chemistry: Screening OPV materials on the World Community Grid, 53rd Sanibel Symposium, St. Simons Island (GA), Feb 2013. (talk)
- The Harvard Clean Energy Project: High-throughput ab initio screening of OPVs via Distributed Volunteer Computing, 2012 MRS Fall Meeting, Boston (MA), Nov 2012. (talk)
- Automated, high-throughput quantum chemistry: Screening OPV materials on the World Community Grid, XIVth International Congress of Quantum Chemistry (XIV-ICQC2012), Boulder (CO), Mar 2012. (poster)
- The Harvard Clean Energy Project: An automated, high-throughput, first-principles screening of organic photovoltaics on the World Community Grid, Séminaire du RQMP Versant Nord, Département de physique, Université de Montréal, Montréal (Canada), Mar 2012. (invited talk)
- Developing renewable energy materials on your idling computer: The Harvard Clean Energy Project on the World Community Grid, 2012 MIT Energy Conference Showcase, Boston (MA), Mar 2012. (poster)
- The Harvard Clean Energy Project: High-throughput screening of OPVs using first-principles electronic structure theory, APS March Meeting 2012, Boston (MA), Feb 2012. (talk)
- The Harvard Clean Energy Project: Automated, large-scale, first-principles screening of carbon-based photovoltaics on the World Community Grid, 20th Conference on Current Trends in Computational Chemistry (CCTCC 20), Jackson (MS), Oct 2011. (poster)
- Developing renewable energy materials on your idling computer: High-throughput in-silico screening of OPVs in the Harvard Clean Energy Project, Global Climate and Energy Project Research Symposium 2011 (GCEP 2011), Stanford (CA), Oct 2011. (poster)
- Quantum chemistry on the World Community Grid: a large-scale screening of molecular motifs for OPVs, 9th Triennial Congress of the World Association of Theoretical and Computational Chemists 2011 (WATOC 2011), Santiago de Compostela (Spain), Jul 2011. (poster)
- The Harvard Clean Energy Project: first-principles screening of OPV materials on the World Community Grid, APS March Meeting 2011, Dallas (TX), Mar 2011. (talk)
- Developing renewable energy materials on your idling computer: the Harvard Clean Energy Project on the World Community Grid, 2011 MIT Energy Conference Showcase, Boston (MA), Mar 2011. (poster)
- First-principles screening and design of organic photovoltaic materials on the World Community Grid: The Clean Energy Project, Workshop on Wavepackets, Chaos, and Scattering: from Chemistry to Physics and back, Cambridge (MA), Oct 2010. (poster)
- The Harvard Clean Energy Project: First-principles study of molecular motifs for OPVs on the World Community Grid, 46th Symposium on Theoretical Chemistry ‘Quantum Chemistry for Large and Complex Systems: From Theory to Algorithms and Applications’, Münster (Germany), Sep 2010. (talk)
- First-principles screening and design of organic photovoltaic materials on the World Community Grid, 240th ACS National Meeting, Boston (MA), Aug 2010. (talk)
- The Harvard Clean Energy Project: A large scale computational search for new organic photovoltaics on the World Community Grid, CIMOPV (Complex Interactions & Mechanisms in Organic Photovoltaics) Workshop, Brisbane (Australia), Jul 2010. (invited talk)
- First-principles screening and design of organic photovoltaic materials on the World Community Grid: The Clean Energy Project, Molecular Quantum Mechanics 2010. An International Conference in Honor of Professor Henry F. Schaefer III (MQM 2010), Berkeley (CA), May 2010. (poster)
- The Harvard Clean Energy Project: A large scale computational search for new organic photovoltaics, 3rd Puerto Rico NSF EPSCoR/RII IFN Annual Meeting, Rio Grande (PR), May 2010. (invited talk)
- Screening and design of renewable energy materials on the World Community Grid, 2010 MIT Energy Conference Showcase, Boston (MA), Mar 2010. (poster)
- Electronic structure of 3d-M(smif)2: A case study for computational investigations of coordination compounds and their spectroscopic characterization, XIIIth International Congress of Quantum Chemistry (XIII-ICQC2009), Helsinki (Finland), Jun 2009. (poster)
- Formal oxidation states and realistic charge distributions in transition metal chemistry, XIIIth International Congress of Quantum Chemistry Satellite Symposium ‘Molecular Properties ’09 – Bridging the Gap between Theory and Experiment (MP09)’, Oslo (Norway), Jun 2009. (poster)
- The electronic structure of 3d-M(smif)2: A testing ground for computational investigations of organometallic complexes and their spectroscopic characterization, 92nd Canadian Chemistry Conference and Exhibition (CSC 2009), Hamilton (ON), Jun 2009. (poster)
- Application of ab initio DMRG to the physics of conjugated π-electron systems, 8th Triennial Congress of the World Association of Theoretical and Computational Chemists 2008 (WATOC 2008), Sydney (Australia), Sep 2008. (poster)
- Ab initio DMRG methodology and studies of organic electronic materials, 236th ACS National Meeting, Philadelphia (PA), Aug 2008. (poster)
- Recent progress in ab initio DMRG methodology, APS March Meeting 2008, New Orleans (LA), Mar 2008. (talk)
- Ab initio DMRG methodology and studies of organic electronic materials, 48th Sanibel Symposium, St. Simons Island (GA), Feb 2008. (poster)
- The hidden radical nature of the acenes, 234th ACS National Meeting, Boston (MA), Sep 2007. (poster)
- The radical character of the acenes, Molecular Quantum Mechanics – Analytic Gradients and Beyond.
An International Conference in Honor of Professor Peter Pulay (MQM 2007), Budapest (Hungary), Jun 2007. (poster) - On the nature of the oligoacene ground state, International Conference on Strongly Correlated Electron Systems (SCES’07), Houston (TX), May 2007. (poster)
- On the nature of the oligoacene ground state, APS March Meeting 2007, Denver (CO), Mar 2007. (poster)
- Quadratic scaling ab initio DMRG for strong nondynamic correlation, APS March Meeting 2007, Denver (CO), Mar 2007. (talk)
- Quadratic scaling ab initio DMRG for strong nondynamic correlation, 232nd ACS National Meeting, San Francisco (CA), Sep 2006. (poster)
- Quadratic scaling ab initio DMRG for strong nondynamic correlation, 232nd ACS National Meeting, San Francisco (CA), Sep 2006. (talk)
- Quadratic scaling ab initio DMRG for strong nondynamic correlation, 42nd Symposium on Theoretical Chemistry ‘Quantum Chemistry − Methods and Applications’, Erkner/Berlin (Germany), Sep 2006. (poster)
- Quadratic scaling ab initio DMRG for strong multireference correlation, XIIth International Congress of Quantum Chemistry (XII-ICQC2006), Kyoto (Japan), May 2006. (poster)
- Quadratic scaling ab initio DMRG for strong multireference correlation, XIIth International Congress of Quantum Chemistry Satellite Meeting ‘Chemical Accuracy and Beyond – Electron Correlation, DFT, and Breakdown of Born-Oppenheimer Scheme’, Tokyo (Japan), May 2006. (poster)
- Nodal hypersurfaces in many-electron wavefunctions, Molecular Quantum Mechanics – The No Nonsense Path to Progress. An International Conference in Honour of Professor Nicholas C. Handy (MQM 2004), Cambridge (UK), Jul 2004. (poster)
- Nodal hypersurfaces in many-electron wavefunctions, GDCh-JCF Spring Symposium, Heidelberg (Germany), Apr 2004. (talk)
- Nodal hypersurfaces in many-electron wavefunctions, GDCh-JCF Spring Symposium, Heidelberg (Germany), Apr 2004. (poster)