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Mostrati risultati da 1 a 20 di 61
Data di pubblicazione Titolo Autori Tipologia Autore(i) File
1-gen-2004 (2004) Struttura, natura del legame e proprietà elettroniche di SrTiO3 e Sr1-3x/2LaxTiO3 MERLI, MarcelloBINI, Miriam + 10 - Proceedings::Proceedings MERLI M; R GALBONI; S GELOSA; D CAPSONI; M BINI; V MASSAROTTI
1-gen-2004 (2004) Ottimizzazione del raffinamento strutturale con i minimi quadrati mediante riconoscimento ed eliminazione degli outlier attraverso la combinazione di «leverage analysis» e «Cook’s distance» MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; D BERNINI; G PEDRAZZI
1-gen-2004 Investigating structural properties of crystal at high pressures: a contribution from the Bader analysis of the electron density MERLI, Marcello + 10 - Proceedings::Proceedings M PRENCIPE; MERLI M; S GELOSA R GALBONI
1-gen-2004 SYNTHESIS OF 3-SUBSTITUTED DIHYDRO-1-1PHENYLAMINO-1H-PYRROLO[1,2-A]IMIDAZOLE-2,5(3H,6H)-DIONES FROM A-AMINO ACID PHENYLHYDRAZIDES AND LEVULINIC ACID MERLI, Marcello + 01 - Contributo in rivista::1.01 Articolo in rivista VERARDO; G; GEATTI; P; MARTINUZZI; M; MERLI M
1-gen-2004 (2004) Miglioramento della mappa di densità elettronica ottenuta con il Maximum Entropy Method MERLI, Marcello 10 - Proceedings::Proceedings MERLI M
1-gen-2004 Getting reliable experimental electron density maps of pure compounds and solid solution by Maximum Entropy Method MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; A PAVESE
1-gen-2005 Ab initio calculation at DFT level of NaGaSi2O6 and LiAlSi2O6 pyroxenes: a comparison from the Bader's topology viewpoint MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; F NESTOLA; M PRENCIPE
1-gen-2005 Ab initio quantum-mechanical simulation of the adsorption process of Ti, Ca, Na by a corundum crystal: inferences on defects of industrial glass MERLI, MarcelloBRUNO, Maurizio + 10 - Proceedings::Proceedings MASSIMO BOIOCCHI; MERLI M; ELISABETTA NEGRI; MAURO PRENCIPE; BRUNO MESSIGA
1-gen-2005 M1-site in dioctahedral micas: a novel approach from information theory to fix its content MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; APAVESE; N CURETTI;
1-gen-2005 Investigating structural properties of crystal at high pressures by means of Bader analysis of the electron density: some methodological warning MERLI, MarcelloCastellucci, Marcello + 10 - Proceedings::Proceedings M PRENCIPE; MERLI M; M CASTELLUCCI; F AMATO
1-gen-2005 Negative thermal expansion in cuprite-type compounds: A combined synchrotron XRPD, EXAFS, and computational study of Cu2O and Ag2O MERLI, Marcello + 10 - Proceedings::Proceedings GILBERTO ARTIOLI; MONICA DAPIAGGI; PAOLO FORNASINI; ANDREA SANSON; FRANCESCO ROCCA; MERLI M
1-gen-2005 Calculation of the effective charges of the atomic basins from ab initio Hartree-Fock electron densities in NaAlSi2O6 and NaTiSi2O6 pyroxenes MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; S NAZARENI; M PRENCIPE
1-gen-2005 Outlier recognition in the crystal structure least-squares modelling by diagnostic techniques based on leverage analysis MERLI, Marcello 01 - Contributo in rivista::1.13 Abstract in rivista MERLI M
1-gen-2006 MEM reconstruction of the experimental electron density: limits and possible applications MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; PAVESE A
1-gen-2006 Negative thermal expansion in cuprite-type compounds: A combined synchrotron XRPD, EXAFS, and computational study of Cu2O and Ag2O MERLI, Marcello + 01 - Contributo in rivista::1.01 Articolo in rivista ARTIOLI, G; DAPIAGGI, M; FORNASINI, P; SANSON, A; ROCCA, F; MERLI, M
1-gen-2006 5-Substituted 4,5-Dihydro-1,2,4-triazin-3(2H)-ones from the Unprecedented Reaction between α-N-Protected Amino Acid Hydrazides and NaBH4 MERLI, Marcello + 01 - Contributo in rivista::1.01 Articolo in rivista Verardo, G; Geatti, P; Merli, M; Strazzolini, P
1-gen-2006 La ricostruzione della densità elettronica sperimentale mediante il metodo di massimizzazione della entropia: il caso delle fengiti MERLI, Marcello + 10 - Proceedings::Proceedings MERLI M; PAVESE A
1-gen-2006 About the reliability of the Maximum Entropy Method in reconstructing electron density: the case of MgO MERLI, Marcello + 01 - Contributo in rivista::1.01 Articolo in rivista MERLI M; PAVESE A
1-gen-2008 Maximum entropy method: an unconventional approach to explore observables related to the electron density in phengites MERLI, Marcello + 01 - Contributo in rivista::1.01 Articolo in rivista MERLI M; ALESSANDRO PAVESE; NADIA CURETTI
1-gen-2009 Bader's topologycal analysis of the electron density and the laplacian in TOT Phyllosilicates: the case of pyrophyllite and talc SCIASCIA, LucianaMERLI, Marcello + 10 - Proceedings::Proceedings Sciascia, L; Castellucci, M; Merli, M
Mostrati risultati da 1 a 20 di 61
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