CNR Institutional Research Information System

PASTORE, MARIACHIARA

PASTORE, MARIACHIARA  

Istituto di Scienze e Tecnologie Molecolari - ISTM - Sede Milano (attivo dal 18/11/1923 al 31/12/2021)  

Mostra records
Risultati 1 - 20 di 29 (tempo di esecuzione: 0.021 secondi).
Titolo Data di pubblicazione Autore(i) File
Structure and Energetics of Dye-Sensitized NiO Interfaces in Water from Ab Initio MD and Large-Scale GW Calculations 1-gen-2021 Segalina, Alekos; Lebègue, Sébastien; Rocca, Dario; Piccinin, Simone; Pastore, Mariachiara
Effect of the anchoring group in the performance of carbazole-phenothiazine dyads for dye-sensitized solar cells 1-gen-2015 Kankatala S.V. Gupta;Ji Zhang;Gabriele Marotta;Marri Anil Reddy;Surya Prakash Singh;Ashraful Islam;Liyuan Han;Filippo De Angelis;Malapaka Chandrasekharam;Mariachiara Pastore
An Integrated Experimental and Theoretical Approach to the Spectroscopy of Organic-Dye-Sensitized TiO2 Heterointerfaces: Disentangling the Effects of Aggregation, Solvation, and Surface Protonation 1-gen-2014 Marotta, Gabriele; Lobello Maria, Grazia; Anselmi, Chiara; Consiglio Gabriella, Barozzino; Calamante, Massimo; Mordini, Alessandro; Pastore, Mariachiara; DE ANGELIS, Filippo
Charge-displacement analysis for excited states 1-gen-2014 Ronca, E; Pastore, M; Belpassi, L; De Angelis, F; Angeli, C; Cimiraglia, R; Tarantelli, F
Computational modeling of single-versus double-anchoring modes in di-branched organic sensitizers on TiO2 surfaces: structural and electronic properties 1-gen-2014 Calbo, Joaquin; Pastore, Mariachiara; Mosconi, Edoardo; Orti, Enrique; DE ANGELIS, Filippo
Density Relaxation in Time-Dependent Density Functional Theory: Combining Relaxed Density Natural Orbitals and Multireference Perturbation Theories for an Improved Description of Excited States 1-gen-2014 Ronca, Enrico; Angeli, Celestino; Belpassi, Leonardo; DE ANGELIS, Filippo; Tarantelli, Francesco; Pastore, Mariachiara
Effect of molecular fluctuations on hole diffusion within dye monolayers 1-gen-2014 Vaissier, V; Mosconi, E; Moia, D; Pastore, M; Frost, Jm; De Angelis, F; Barnes, Prf; Nelson, J
Effect of sensitizer structure and TiO2 protonation on charge generation in dye-sensitized solar cells 1-gen-2014 Ronca, E; Marotta, G; Pastore, M; De Angelis, F
Electronic and Optical Properties of Dye-Sensitized TiO2 Interfaces 1-gen-2014 Pastore, Mariachiara; Selloni, Annabella; Fantacci, Simona; DE ANGELIS, Filippo
Modeling Materials and Processes in Dye-Sensitized Solar Cells: Understanding the Mechanism, Improving the Efficiency 1-gen-2014 Pastore; Mariachiara;De Angelis; Filippo
Energy-level alignment in organic dye-sensitized TiO<sub>2</sub> from GW calculations 1-gen-2013 Umari, P; Giacomazzi, L; De Angelis, F; Pastore, M; Baroni, Stefano
Influence of the dye molecular structure on the TiO2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects 1-gen-2013 A, Enrico Ronca; B, ; Pastore, Mariachiara; Belpassi, Leonardo; A, Francesco Tarantelli; B, ; DE ANGELIS, Filippo
Influence of the dye molecular structure on the TiO2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects 1-gen-2013 Ronca, Enrico; Pastore, Mariachiara; Belpassi, Leonardo; Tarantelli, Francesco; DE ANGELIS, Filippo
Intermolecular Interactions in Dye-Sensitized Solar Cells: A Computational Modeling Perspective 1-gen-2013 Mariachiara Pastore; Filippo De Angelis
Modeling Excited States and Alignment of Energy Levels in Dye-Sensitized Solar Cells: Successes, Failures, and Challenges 1-gen-2013 Mariachiara Pastore; Simona Fantacci; Filippo De Angelis
Modeling the effect of ionic additives on the optical and electronic properties of a dye-sensitized TiO2 heterointerface: absorption, charge injection and aggregation 1-gen-2013 Agrawal, Saurabh; Leijtens, Tomas; Ronca Enrico, Ac; Pastore, Mariachiara; Snaith, Henry; DE ANGELIS, Filippo
Novel Carbazole-Phenothiazine Dyads for Dye-Sensitized Solar Cells: A Combined Experimental and Theoretical Study 1-gen-2013 Marotta, Gabriele; Reddy Marri, Anil; Singh Surya, Prakash; Islam, Ashraful; Han, Liyuan; DE ANGELIS, Filippo; Pastore, Mariachiara; Chandrasekharam, Malapaka
Optical Properties and Aggregation of Phenothiazine-Based Dye-Sensitizers for Solar Cells Applications: A Combined Experimental and Computational Investigation 1-gen-2013 Agrawal, Saurabh; Pastore, Mariachiara; Marotta, Gabriele; Anil Reddy, Marri; Chandrasekharam, Malapaka; DE ANGELIS, Filippo
Adsorption of organic dyes on TiO2 surfaces in dye-sensitized solar cells: interplay of theory and experiment 1-gen-2012 Chiara Anselmi ; Edoardo Mosconi ; Mariachiara Pastore ; Enrico Ronca ; Filippo De Angelis
First-Principles Computational Modeling of Fluorescence Resonance Energy Transfer in Co-Sensitized Dye Solar Cells 1-gen-2012 Pastore, Mariachiara; DE ANGELIS, Filippo