{"id":9543,"date":"2015-09-09T10:32:12","date_gmt":"2015-09-09T08:32:12","guid":{"rendered":"http:\/\/www.ehu.eus\/chemistry\/theory\/?p=9543"},"modified":"2016-04-11T15:05:48","modified_gmt":"2016-04-11T13:05:48","slug":"2015-talks-conference-contributions-assistance","status":"publish","type":"post","link":"https:\/\/www.ehu.eus\/chemistry\/theory\/5_kt-seminars\/2015-talks-conference-contributions-assistance\/","title":{"rendered":"2015 Talks, conference contributions & assistance"},"content":{"rendered":"

29. Type of contribution<\/strong>:<\/b> Invited Lecture
\nAuthor<\/strong>:<\/strong> Jesus M. Ugalde
\nCongress<\/strong>: <\/strong>The International Chemical Congress of Pacific Basin Societies 2015<\/a>
\nTitle: <\/strong>Electron-pair distribution functions for electron correlation studies
\nPlace<\/strong>: Honolulu, Hawaii, USA
\nDate<\/strong>: December 15 – 20, 2015<\/p>\n

 <\/p>\n

28. Type of contribution<\/strong>:<\/b>\u00a0Contributed Talk
\nAuthor<\/strong>:<\/strong>\u00a0Andreas Heidenreich
\nCongress<\/strong>:\u00a0<\/strong>Clustertreffen 2015<\/a>
\nTitle:\u00a0<\/strong>Efficiency of dopant-induced ignition of helium nanodroplets
\nPlace<\/strong>:\u00a0Lindow (Germany)
\nDate<\/strong>: September 20-25<\/div>\n

 <\/p>\n

27. Type of contribution<\/strong>:<\/b> Invited (plenary) lecture
\nAuthor<\/strong>:<\/strong> S. J. Grabowski
\nCongress<\/strong>: <\/strong>Modeling Interactions in Biomolecules VII<\/a>
\nTitle: <\/strong>Protonation of alkanes by carborane superacids – towards the topological acidity scale
\nPlace<\/strong>: Prague (Czech Republic)
\nDate<\/strong>: September 14-18<\/div>\n

 <\/p>\n

26. Type of contribution<\/strong>:<\/b>\u00a0Contributed Talk<\/div>\n
\n
Author<\/strong>:<\/strong>\u00a0Andreas Heidenreich
\nCongress<\/strong>:\u00a0<\/strong>3rd International Conference on Correlation Effects in Radiation Fields\u00a0(CERF15)<\/a>
\nTitle:\u00a0<\/strong>Efficiency of dopant-induced ignition of helium nanodroplets
\nPlace<\/strong>:\u00a0Rostock (Germany)
\nDate<\/strong>: September 13-18<\/div>\n

 <\/p>\n<\/div>\n

25. Type of contribution<\/strong>:<\/b>\u00a0Contributed Talk
\nAuthor<\/strong>:<\/strong>\u00a0Mario Piris
\nCongress<\/strong>:\u00a0<\/strong>PSI-K 2015 Conference (Psi-K 2015)<\/a>
\nTitle:\u00a0<\/strong>Towards an N-representable 1-RDM theory
\nPlace<\/strong>: Donostia
\nDate<\/strong>: September 6 – 10<\/div>\n

 <\/p>\n

24. Type of contribution:<\/strong> Oral communication.
\nAuthor:<\/strong> Mauricio Rodr\u00edguez-Mayorga
\nCongress: <\/strong>16th International Conference on Density Functional Theory and its Applications<\/a>
\nTitle<\/strong>: On the effect of electron correlation in 3-RDM approximations<\/a>
\n<\/span><\/div>\n
Place<\/strong>: Debrecen, Hungary.
\nDate<\/strong>:\u00a0August\u00a031 – September 4.<\/div>\n

 <\/p>\n

23. Type of contribution: <\/strong>Oral communication.
\nAuthor: <\/strong>Eloy Ramos-Cordoba
\nCongress: <\/strong>16th International Conference on Density Functional Theory and its Applications<\/a><\/span><\/div>\n
Title: <\/strong>Understanding and quantifying electron correlation<\/a>
\nPlace<\/strong>:Debrecen, Hungary.
\nDate<\/strong>:\u00a0August\u00a031 – September 4<\/div>\n

 <\/p>\n

22. Type of contribution<\/strong>: Oral Communication
\nAuthor<\/strong>: Eduard Matito
\nConference<\/strong>: 16th International Conference on Density Functional Theory and its Applications<\/a><\/span>
\nTitle<\/strong>: Harmonium atom as a calibration and development tool in DFT
\nPlace<\/strong>: Debrecen, Hungary
\nDate<\/strong>: August\u00a031 – September 4<\/div>\n

 <\/p>\n

21. Type of contribution:<\/strong> Invited Lecture
\nAuthor:<\/strong> Jesus M. Ugalde
\nCongress:<\/strong> International Conference on Computational and Experimental Engineering and Sciences <\/a>
\nTitle:\u00a0<\/strong>Structural and Optical Properties of the Naked and Passivated Al5Au5 Bimetallic Nanocluster<\/div>\n
Place:<\/strong> Reno, Nevada, USA
\nDate:<\/strong> July 20 – 24<\/div>\n

 <\/p>\n

<\/div>\n
20. Type of contribution:<\/strong> Poster
\nAuthor:<\/strong> Mauricio Rodr\u00edguez-Mayorga
\nCongress:<\/strong> Hands-on workshop density-functional theory and beyond: First-principles simulations of molecules and materials<\/a>
\nTitle<\/strong>: Selective hybridization, a path for DFT evolution<\/a><\/div>\n
Place:<\/strong> Berlin, Germany
\nDate:<\/strong> July 13 – 23<\/div>\n

 <\/p>\n

<\/div>\n
19. Type of contribution:<\/strong> oral communication
\nAuthor:<\/strong> S. J. Grabowski
\nCongress: <\/strong>Third EuCheMS Inorganic Chemistry Conference<\/a>
\nTitle: <\/strong>Splitting of hydrogen by activation at a single non-metallic center<\/div>\n
Place: <\/strong>Wroc\u0142aw (Poland)
\nDate:<\/strong> June 28 – July 1<\/div>\n

 <\/p>\n

18. Type of contribution:<\/strong> Invited Lecture
\nAuthor:<\/strong> Jesus M. Ugalde
\nCongress:<\/strong> International Conference on Chemical Bonding<\/a>
\nTitle:\u00a0<\/strong>Aromaticity in Small Inorganic Rings. A “stretch” or a “gizmo” ?<\/div>\n
Place:<\/strong> Kauai, Hawaii, USA
\nDate:<\/strong> July 2 – 6<\/div>\n

 <\/p>\n

17. Type of contribution:\u00a0<\/strong>Invited Lecture
\nAuthor:<\/strong>\u00a0Mario Piris<\/span>
\nCongress<\/strong>:\u00a0<\/strong>10th Seminars of Advanced Studies on Molecular Design and Bioinformatics (SEADIM 10)<\/a>
\nTitle:\u00a0<\/strong>Towards an N-representable 1-RDM theory
\nPlace<\/strong>: Varadero, Cuba
\nDate<\/strong>:\u00a0June 23 – 28<\/div>\n

 <\/p>\n

16. Type of contribution<\/strong>: Invited Lecture<\/span><\/div>\n

Author<\/strong>: David Casanova
\nConference<\/strong>: Singlet fission workshop<\/a>
\nTitle<\/strong>: Singlet fission into a pair of bright states
\nPlace<\/strong>: Lyons, Colorado, USA
\nDate<\/strong>: June 20 – 23<\/p>\n

<\/div>\n

15.<\/strong> Type of contribution<\/strong>: Invited Lecture
\n<\/span>Author<\/strong>: Eduard Matito
\nConference<\/strong>: 15th V.A. Fock Meeting on Quantum and Computational Chemistry<\/a>
\nTitle<\/strong>: New Measures of Dynamic Electron Correlation in Terms of Natural Orbitals and Their Occupancies
\nPlace<\/strong>: Vladivostok (Russia)
\nDate<\/strong>: June 19 – 24<\/p>\n

<\/div>\n
14. Type of contribution:<\/strong> Invited Lecture
\nAuthor:<\/strong> Jesus M. Ugalde
\nCongress:<\/strong> Math\/Chem\/Comp (Mathematics, Chemistry, Computers<\/a>
\nTitle:\u00a0<\/strong>Quantum Molecular Dynamical Studies of the Li(+)-Ferrocene Complex<\/div>\n
Place:<\/strong> Dubrovnik, Croatia
\nDate:<\/strong> June 12 – 19<\/div>\n

 <\/p>\n

13. Type of contribution:\u00a0<\/strong>Poster
\nAuthor:<\/strong>\u00a0Mario Piris
\nCongress:\u00a0<\/strong>The 15th International Congress of Quantum Chemistry (ICQC 15)<\/a><\/div>\n
Title:\u00a0<\/strong>Towards an N-representable Natural Orbital Functional Theory
\nPlace<\/strong>:\u00a0Beijing, China
\nDate<\/strong>: June 8 – 13<\/div>\n

 <\/p>\n

12.<\/strong> Type of contribution<\/strong>: Poster
\n<\/span>Author<\/strong>: David Casanova
\nConference<\/strong>: The 15th International Congress of Quantum Chemistry (ICQC 15)<\/a>
\nTitle<\/strong>: Tetraradical characterization through electronic structure calculations: theory and examples
\nPlace<\/strong>: Beijing, China
\nDate<\/strong>: June 8 – 13<\/p>\n

11. Type of contribution:<\/strong> Poster
\nAuthor<\/strong>:<\/strong> Jon M. Matxain
\nCongress<\/strong>: <\/strong>7th International Theoretical Biophysics Symposium (THEOBIO 2015)<\/a>
\nTitle: <\/strong>Attack of OH radical to the OH- and S-containing amino acids<\/a>
\nPlace<\/strong>: Cagliari, Italia
\nDate<\/strong>: June 8 – 12.<\/div>\n

 <\/p>\n

10. Type of contribution<\/strong>: <\/strong>Poster
\n<\/strong> Author<\/strong>: <\/strong>Elena Formoso
\nCongress<\/strong>: <\/strong>7th International Theoretical Biophysics Symposium (THEOBIO 2015)<\/a>
\nTitle:\u00a0<\/strong> Effect of Al(III) on coenzyme NADH in solution
\nPlace<\/strong>: Cagliari, Italy
\nDate<\/strong>: June 8 – 12<\/div>\n

 <\/p>\n

9. Type of contribution<\/strong>: <\/strong>Oral Communication
\n<\/strong><\/strong> Author<\/strong>: <\/strong>Jon I. Mujika
\nCongress<\/strong>: <\/strong>7th International Theoretical Biophysics Symposium (THEOBIO 2015)<\/a>
\nTitle:\u00a0<\/strong> Understanding by means of quantum chemistry how Aluminum is coordinated to an Amyloid Ab peptide.
\nPlace<\/strong>: Cagliari, Italy
\nDate<\/strong>: June 8 – 12<\/div>\n

 <\/p>\n

8. Type of contribution:\u00a0<\/strong>Invited Lecture
\nAuthor:<\/strong>\u00a0Mario Piris<\/span>
\nCongress:\u00a0<\/strong>Recent Advances in Electronic Structure Theory (RAEST 2015)<\/a>
\n<\/strong><\/div>\n
Title:\u00a0<\/strong>Towards an N-representable NOF theory
\nPlace<\/strong>:\u00a0Nanjing, China
\nDate<\/strong>: June 1 – 6<\/div>\n

 <\/p>\n

7. Type of contribution:<\/strong> Flash Communication
\nAuthor:<\/strong> Eduard Matito
\nCongress:\u00a0<\/strong>Recent Advances in Electronic Structure Theory (RAEST 2015)<\/a>
\nTitle<\/strong>: Understanding and Quantifying Electron Correlation<\/div>\n
Place<\/strong>: Nanjing (China)<\/div>\n
Date<\/strong>: June 1 – 6<\/div>\n

 <\/p>\n

6. Type of contribution<\/strong>: Poster
\n<\/span>Author<\/strong>: David Casanova
\nConference<\/strong>: Recent Advances in Electronic Structure Theory (RAEST 2015)<\/a>
\nTitle<\/strong>: Recent advances within the restricted active space configuration interaction spin flip method
\nPlace<\/strong>: Nanjing, China
\nDate<\/strong>: June 1 – 6<\/div>\n

 <\/p>\n

5. Type of contribution:\u00a0<\/strong>Attendance\u00a0
\nAuthor: <\/strong>Eloy Ramos-Cordoba<\/div>\n
Congress: <\/strong>Workshop on “Advances on electronic structure theory<\/a>
\nPlace<\/strong>: Paris, France.
\nDate<\/strong>: April 27 – 29<\/span><\/span>.<\/div>\n

 <\/p>\n

\u00a04. Type of contribution<\/strong>: Invited Lecture<\/span><\/div>\n

Author<\/strong>: David Casanova
\nConference<\/strong>: Modeling photoactive molecules
\nTitle<\/strong>: Electronic structure studies on singlet exciton fission
\nPlace<\/strong>: Nantes, France
\nDate<\/strong>: April 21 – 24<\/p>\n

3. Type of contribution: <\/strong>Keynote Speaker
\nAuthor<\/strong>:<\/strong> Jon M. Matxain
\nCongress<\/strong>: <\/strong>ImagineNano 2015<\/a>.
\nTitle: <\/strong> Novel Solid Polymorphs by Self-Assembling of Nanoclusters<\/a>
\nPlace<\/strong>: Bilbao
\nDate<\/strong>: March 10 – 13.<\/div>\n

 <\/p>\n

2. Type of contribution: <\/strong>Oral Communication
\n<\/strong> Author<\/strong>: <\/strong>Elena Formoso
\nCongress<\/strong>:\u00a0<\/strong>The Eleventh Keele Meeting on Aluminium: The Natural History of Aluminium, past, present, future<\/a>
\nTitle:\u00a0<\/strong> Effect of Al(III) on coenzyme NADH in solution
\nPlace<\/strong>: Lille, France
\nDate<\/strong>: 28 February- 4 March<\/div>\n

 <\/p>\n

1. Type of contribution: <\/strong>Oral Communication<\/div>\n
Author<\/strong>: <\/strong>Jon I. Mujika
\nCongress<\/strong>:\u00a0<\/strong>The Eleventh Keele Meeting on Aluminium: The Natural History of Aluminium, past, present, future<\/a>
\nTitle:\u00a0<\/strong> Identifying Aluminum Binding Sites in Amyloid Ab peptide by Means of Computational Chemistry
\nPlace<\/strong>: Lille, France
\nDate<\/strong>: 28 February – 4 March<\/div>\n","protected":false},"excerpt":{"rendered":"

29. Type of contribution: Invited Lecture Author: Jesus M. Ugalde Congress: The International Chemical Congress of Pacific Basin Societies 2015 Title: Electron-pair distribution functions for electron correlation studies Place: Honolulu, Hawaii, USA Date: December 15 – 20, 2015   28. Type of contribution:\u00a0Contributed Talk Author:\u00a0Andreas Heidenreich Congress:\u00a0Clustertreffen 2015 Title:\u00a0Efficiency of dopant-induced ignition of helium nanodroplets […]<\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"_acf_changed":false,"footnotes":""},"categories":[78],"tags":[],"class_list":["post-9543","post","type-post","status-publish","format-standard","hentry","category-5_kt-seminars"],"blocksy_meta":[],"acf":[],"_links":{"self":[{"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/posts\/9543","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/comments?post=9543"}],"version-history":[{"count":50,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/posts\/9543\/revisions"}],"predecessor-version":[{"id":10320,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/posts\/9543\/revisions\/10320"}],"wp:attachment":[{"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/media?parent=9543"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/categories?post=9543"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/www.ehu.eus\/chemistry\/theory\/wp-json\/wp\/v2\/tags?post=9543"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}