2001-2009

Presentations at Conferences and Invited Lectures prior to Michigan Tech.

 

2010

L. Valenzano, C. Lamberti – NIS Colloquium – MOFCAT, Turin – Italy, February 2010 (UiO-66 structure understanding through the combined use of XRPD, EXAFS and modelling) – Invited Platform

L. Valenzano, G. Palomino, B. Civalleri, C. Otero-Arean – Gas storage and gas separation using porous materials, CECAM Workshop, Lausanne – CH, May 2010 (Computational and Experimental Studies on the Adsorption of CO, CO2 and N2 on MOF-74-Mg) – Invited Platform

L.Valenzano – Imperial College, Department of Chemistry, London – UK, March 2010 (Theoretical investigation of metal-organic frameworks (MOFs): structures, vibrations and adsorption properties) – Invited Seminar

S. Chavan, L. Valenzano, B. Civalleri, C. Lamberti, K.P. Lillerud, S. Bordiga – 16th International Zeolite Conference (16th IZC), Sorrento – I, 2010 (Dr. S. Chavan) (Disclosing the complex structure of UiO-66 metal organic framework: a synergic combination of experiment and theory) – Platform

C. Lamberti, L. Valenzano, B. Civalleri, S. Bordiga – XVIII Meeting of the Italian Society for Synchrotron Radiation, Padova – I, 2010 (Dr. C. Lamberti) (UiO-66 structure understanding through the combined use of XRPD, EXAFS and modelling) – Poster

M. De La Pierre, L. Valenzano, F. Pascale, Y. Noel, C. Zicovich-Wilson, R. Orlando, R. Dovesi – ESPA2010 Electronic Structure: Principles and Applications, Oviedo – ES, 2010 (Mr. M. De La Pierre) (Ab initio simulation of the IR spectra of pyrope, grossular, and andradite) – Poster

 

2009

L. Valenzano, B. Civalleri – MOFCAT Project Meeting, Humboldt University, Institute of Chemistry, Berlin – DE, May 2009 (Energetics and Spectroscopies of small molecules in MOFs) – Invited Platform

L. Valenzano – 3rd Summer School in Solid State Chemistry, University of Barcelona, Barcelona – ES, July 2009 (CRYSTAL06 input/output: basic features) – Invited Lecture

L. Valenzano – 3rd Summer School in Solid State Chemistry, University of Barcelona, Barcelona – ES, July 2009 (Geometry optimization techniques in solid state chemistry) – Invited Lecture

L. Valenzano – 3rd Summer School in Solid State Chemistry, University of Barcelona, Barcelona – ES, July 2009 (Modeling of surfaces in solid state chemistry) – Invited Lecture

L. Valenzano – 3rd Summer School in Solid State Chemistry, University of Barcelona, Barcelona – ES, July 2009 (Modeling of defects in solid state chemistry) – Invited Lecture

L. Valenzano – MSSC2009 – Torino Edition, Torino – I, September 2009 (Ab-initio modeling of MOFs) – Invited Platform

L. Valenzano – MSSC2009 – Torino Edition, Torino – I, September 2009 (DFT augmented with an empirical dispersion term) – Invited Platform

L. Valenzano, B. Civalleri, VII Convegno Nazionale INSTM sulla scienza e tecnologia dei materiali, Tirrenia – I, June 2009 (Energetics and Spectroscopies of small molecules in MOFs) – Platform

L. Valenzano, G. Palomino, B. Civalleri, C. Otero-Arean, Catalysis from First principles, Wien – AU, May 2009 (Computational and Experimental Studies on the Adsorption of CO, N2, and CO2 on Mg-MOF-74) – Poster

L. Valenzano, G. Palomino, B. Civalleri, C. Otero-Arean, MOFs on the road to applications, Oslo Innovation Center, Oslo – N, May 2009 (Computational and Experimental Studies on the Adsorption of CO, N2, and CO2 on Mg-MOF-74) – Poster

L. Valenzano, G. Palomino, B. Civalleri, C. Otero-Arean, MSSC2009 – Torino Edition, Torino – I, September 2009 (Computational and Experimental Studies on the Adsorption of CO, N2, and CO2 on Mg-MOF-74) – Poster

L. Valenzano, B. Civalleri, S. Bordiga, C. Lamberti, MSSC2009 – Torino Edition, Torino – I, September 2009 (UiO-66 structure understanding through the combined use of XRPD, EXAFS and modelling) – Poster

L. Valenzano, G. Palomino, B. Civalleri, C. Otero-Arean, VII Convegno Nazionale INSTM sulla scienza e tecnologia dei materiali, Tirrenia (Pisa) – I, June 2009 (Computational and Experimental Studies on the Adsorption of CO, N2, and CO2 on Mg-MOF-74) – Poster

L. Valenzano, B. Civalleri, S. Bordiga, C. Lamberti, VII Convegno Nazionale INSTM sulla scienza e tecnologia dei materiali, Tirrenia (Pisa) – I, June 2009 (UiO-66 structure understanding through the combined use of XRPD, EXAFS and modelling) – Poster 

C. Lamberti, L. Valenzano, B. Civalleri, S. Bordiga – Operando III – 3rd International Congress on Operando Spectroscopy, Rostock – DE, 2009 (Dr. C. Lamberti) (UiO-66 structure understanding through the combined use of XRPD, EXAFS and modeling) – Platform

R. Blom, S. Bordiga, L. Valenzano, B. Civalleri – Workshop on Advanced Porous Materials for CO2 adsorption, Liblice – CK, May 2009 (Dr. R. Blom, Sintef) (The Role of Open Metal Sites when Adsorbing CO2 on Metal-Organic Framework based Adsorbents) – Platform

S. Bordiga, R. Blom, L. Valenzano, B. Civalleri – VII Convegno Nazionale INSTM sulla scienza e tecnologia dei materiali, Tirrenia (Pisa) – I, 2009 (Dr. S. Bordiga) (The Role of Open Metal Sites when Adsorbing CO2 on Metal-Organic Framework based Adsorbents) – Platform

J. Sauer, K. Sillar, L. Valenzano, B. Civalleri – MOFs on the road to applications, Oslo Innovation Center, Oslo – N, 2009 (Prof. J. Sauer) (Accurate energetics of transition structures and intermediates by hybrid MP2:DFT and DFT+Disp calculations) – Platform

J. Vitillo, S. Chavan, S. Bordiga, C. Lamberti, L. Valenzano, B. Civalleri – MOFs on the road to applications, Oslo Innovation Center, Oslo – N, 2009 (Dr. J.G. Vitillo) (H2 storage in isostructural UiO-67 and UiO-66 MOFs) – Platform

S. Bordiga, R. Blom, L. Valenzano, B. Civalleri – XXIII Congresso Nazionale della Societa’ di Chimica Italiana, Sorrento – I, 2009 (Dr. S. Bordiga) (Role of exposed metal sites in adsorptive properties of M2(DOBDC): combined use of experimental results and ab initio modeling) – Platform

C. Lamberti, J. Vitillo, L. Valenzano, B. Civalleri, S. Bordiga – 14th International conference on X-ray adsorption fine structure, Camerino – I, 2009 (Dr. C. Lamberti) (Local structure of CPO-27-Ni metallorganic framework upon dehydration and coordination of ligand molecules (NO, CO and N2): comparison between experiments and ab initio periodic calculations) – Platform

S. Chavan, J. Vitillo, L. Valenzano, B. Civalleri, S. Bordiga – Advanced micro- and mesoporous materials 2009, Black Sea Coast – BG, 2009 (Dr. S. Chavan) (Computational and Experimental Studies on the Adsorption of CO, N2, and CO2 on Mg-MOF-74) – Poster

 

 

2008

B. Civalleri, L. Valenzano, C. Zicovich-Wilson, R. Orlando – XXXVII Congresso Nazionale di Chimica Fisica, Genoa – I, 2008 (Dr. B. Civalleri) (B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals) – Platform

B. Civalleri, L. Valenzano, C. Zicovich-Wilson, R. Orlando – ECDM-V 5th European Charge Density Meeting, Como – I, June 2008 (Dr. B. Civalleri) (B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals) – Platform

R. Dovesi, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando – Accurate energetics of condensed matter with quantum chemistry, CECAM workshop, Lyon – FR, 2008 (Prof. R. Dovesi) (Quantum mechanical simulation of the vibrational properties of crystalline solids, and interpretation of modes. The case of garnets and related minerals) – Platform

J. Sauer, K. Sillar, L. Valenzano, B. Civalleri – Accurate energetics of condensed matter with quantum chemistry, CECAM workshop, Lyon – FR, 2008 (Dr. J. Sauer) (Accurate energetics of transition structures and intermediates by hybrid MP2:DFT and DFT+Disp calculations) – Platform

A. Meyer, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando, F. Pascale, Y. Noel, R. Dovesi – Accurate energetics of condensed matter with quantum chemistry, CECAM workshop, Lyon – FR, 2008 (Mr. A. Meyer) (Ab-initio periodic simulation of the electronic and magnetic structure of garnets containing transition metals with a local basis set approach) – Poster

A. Meyer, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando, F. Pascale, Y. Noel, R. Dovesi – Ab initio simulation of crystalline solids: history and prospects, Torino – I, 2008 (Mr. A. Meyer) (Ab-initio periodic simulation of the electronic and magnetic structure of garnets containing transition metals with a local basis set approach) – Poster

R. Dovesi, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando – CC7 – 7th European Conference on Computational Chemistry, Venice – I, 2008 (Prof. R. Dovesi) (Key-note lecture: Quantum mechanical simulation of the vibrational properties of crystalline solids, and interpretation of modes. The case of garnets and related minerals.) – Platform

A. Meyer, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando, F. Pascale, Y. Noel, R. Dovesi – CC7 – 7th European Conference on Computational Chemistry, Venice – I, 2008 (Mr. A. Meyer) (Ab-initio periodic simulation of the electronic and magnetic structure of garnets containing transition metals with a local basis set approach) – Poster

R. Dovesi, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando – MSSC2008, London – UK, 2008 (Prof. R. Dovesi) (Quantum mechanical simulation of the vibrational properties of crystalline solids, and interpretation of modes. The case of garnets and related minerals.) – Platform

R. Dovesi, F. Pascale, L. Valenzano, A. Meyer, C. Zicovich-Wilson, Y. Noel, R. Orlando – Mineral spectroscopy by theory and experiment, CECAM workshop, Lausanne – CH, 2008 (Prof. R. Dovesi) (Quantum mechanical simulation of the vibrational properties of crystalline solids, and interpretation of modes. The case of garnets and related minerals.) – Platform

 

2004

L. Valenzano – University of Turin, Chemistry Department, Turin – Italy, December 2004 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential-energy surfaces) – Invited Seminar

L. Valenzano, M. van Hemert, G.J. Kroes, CW conference on Theoretische Chemie en Spectroscopie, Lunteren – NL, 2004 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential-energy surfaces) – Poster

L. Valenzano, M. van Hemert, G.J. Kroes, MOLEC XV: International Conference on Dynamics of Molecular Systems, Nunspeet – NL, 2004 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential- energy surfaces) – Poster

L. Valenzano, M. van Hemert, G.J. Kroes, HRSMC (Holland Research School in Molecular Chemistry) Symposium 2004, Amsterdam – NL, 2004 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential-energy surfaces) – Poster

 

2003

L. Valenzano, M. van Hemert, G.J. Kroes, Multidimensional Quantum Reaction Dynamics 2003, Berlin – DE, 2003 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential energy surfaces) – Poster

L. Valenzano, M. van Hemert, G.J. Kroes, XI International Congress of Quantum Chemistry, Bonn – DE, 2003 (Photodissociation of the water dimer: Three-dimensional quantum dynamics studies on diabatic potential- energy surfaces) – Poster

 

2002

L. Valenzano – University of Leiden, Chemistry Department, Leiden – The Netherlands, April 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Invited Seminar

L. Valenzano – University of Turin, Physics Department, Turin – Italy, April 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Invited Seminar

L. Valenzano – University of Freiburg, Physics Department, Freiburg – Germany, May 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Invited Seminar

L. Valenzano, R.E. Moss, Annual Southern University Spectroscopy Group Meeting, Southampton – UK, 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Platform

L. Valenzano, R.E. Moss, Annual Graduate Student Meeting of the Royal Society of Chemistry, London – UK, 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Platform

L. Valenzano, R.E. Moss, Exploring Modern Computational Chemistry, Nottingham – UK, 2002 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Poster

 

2001

L. Valenzano, R.E. Moss, Charles Coulson Summer School, Oxford – UK, 2001 (Calculations of fully non-adiabatic properties of the Hydrogen molecular cation and its isotopomers) – Poster