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| Issue Date | Title | Author(s) |
|---|---|---|
| 4-Aug-2016 | Exploring the validity of the Glidewell-Lloyd extension of Clar's pi-sextet rule: assessment from polycyclic conjugated hydrocarbons | El Bakouri, Ouissam; Poater i Teixidor, Jordi; Feixas, Ferran; Solà, Miquel |
| 2016 | The variational nature of the gentlest ascent dynamics and the relation of a variational minimum of a curve and the minimum energy path | Bofill i Villà, Josep M.; Quapp, Wolfgang |
| 17-May-2016 | Atomic and molecular data for spacecraft re-entry plasmas | Celiberto, Roberto; Armenise, Iole; Cacciatore, M.; Capitelli, Mario; Esposito, Fabrizio; Gamallo Belmonte, Pablo; Janev, R. K.; Laganà, Antonio; Laporta, Vincenzo; Laricchiuta, Annarita; Lombardi, Andrea; Rutigliano, Maria; Sayós Ortega, Ramón; Tennyson, Jonathan; Wadehra, J. M. |
| 8-Feb-2016 | Pyridinethiolate titanocene metalloligands and their self-assembly reactions to yield early-late metallamacrocycles | Ferrer García, Montserrat; Gomez-Bautista, Daniel; Gutiérrez i Currius, Albert; Orduña Marco, Guillermo; Oro, Luis A.; Pérez Torrente, Jesús J.; Rossell Alfonso, Oriol; Ruiz Sabín, Eliseo |
| 12-Apr-2016 | Tuning Crystal Ordering, Electronic Structure, and Morphology in Organic Semiconductors: Tetrathiafulvalenes as a Model Case | Pfattner, Raphael; Bromley, Stefan Thomas; Rovira i Angulo, Concepció; Mas Torrent, Marta |
| 1-Jun-2016 | Localization versus Delocalization in Chiral Single Component Conductors of Gold Bis(dithiolene) Complexes | Branzea, Diana G.; Pop, Flavia; Auban-Senzier, Pascale; Clerac, Rodolphe; Alemany i Cahner, Pere; Canadell, Enric, 1950-; Avarvari, Narcis |
| 31-Aug-2016 | Planar vs. three-dimensional X-6(2-), X2Y42-, and X3Y32- (X, Y = B, Al, Ga) metal clusters: an analysis of their relative energies through the turn-upside-down approach | El Bakouri, Ouissam; Solà, Miquel; Poater i Teixidor, Jordi |
| 1-Oct-2016 | Assessment of the Sampling Performance of Multiple-Copy Dynamics versus a Unique Trajectory | Pérez González, Juan J.; Santos Tomas, M.; Rubio Martínez, Jaime |
| 1-Feb-2016 | The conversion of CO2 to methanol on orthorhombic β-Mo2C and Cu/β-Mo2C catalysts: mechanism for admetal induced change in the selectivity and activity | Posada Pérez, Sergio; Ramírez, Pedro J.; Gutiérrez, Ramón A.; Stacchiola, Dario J.; Viñes Solana, Francesc; Liu, Ping; Illas i Riera, Francesc; Rodríguez, José A. |
| 5-Feb-2016 | Disclosing the Ligand- and Solvent-Induced Changes on the Spin Transition and Optical Properties of Fe(II)-Indazolylpyridine Complexes | Vela Llausí, Sergi; Gourlaouen, Cristophe; Fumanal Quintana, María; Ribas Ariño, Jordi |