IRIS Institutional Research Information System - AIR Archivio Istituzionale della Ricerca

IRIS è il sistema di gestione integrata dei dati della ricerca (persone, progetti, pubblicazioni, attività) adottato dall'Università degli Studi di Milano.

AIR nasce in UNIMI nel 2006 con lo scopo di raccogliere, documentare e conservare le informazioni sulla produzione scientifica dell'Università degli Studi di Milano e costituisce di fatto l'Anagrafe della ricerca dell'Ateneo.

AIETA, CHIARA DONATELLA

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Dettaglio

Nome completo

AIETA, CHIARA DONATELLA

Afferenza

Dipartimento di Chimica

Pubblicazioni

Risultati 1 - 19 di 19 (tempo di esecuzione: 0.001 secondi).

	Titolo	Data di pubblicazione	Autori	Tipo	File
1	Anharmonic quantum nuclear densities from full dimensional vibrational eigenfunctions with application to protonated glycine	28-ago-2020	AIETA, CHIARA DONATELLA ; MICCIARELLI, MARCO ; BERTAINA, GIANLUCA ; CEOTTO, MICHELE	Article (author)	Open Access
2	Doped nano-titania: theoretical insight into structure-property relationships	set-2014	CEOTTO, MICHELE ; LO PRESTI, LEONARDO ; LOCONTE, LAURA ; MERONI, DANIELA ; FALCIOLA, LUIGI ; PIFFERI, VALENTINA ; SOLIVERI, GUIDO ; CAPPELLETTI, GIUSEPPE ; AIETA, CHIARA DONATELLA ; Robert G. Acres; ARDIZZONE, SILVIA	Conference Object	-
3	An efficient computational approach for the calculation of the vibrational density of states	8-giu-2016	GABAS, FABIO ; AIETA, CHIARA DONATELLA ; CEOTTO, MICHELE	Conference Object	Open Access
4	An Efficient Computational Approach for the Calculation of the Vibrational Density of States	3-feb-2016	AIETA, CHIARA DONATELLA ; GABAS, FABIO ; CEOTTO, MICHELE	Article (author)	Open Access
5	Improved semiclassical dynamics through adiabatic switching trajectory sampling	7-dic-2019	CONTE, RICCARDO ; PARMA, LORENZO ; AIETA, CHIARA DONATELLA ; ROGNONI, ALESSANDRO ; CEOTTO, MICHELE	Article (author)	Open Access
6	Machine learning for vibrational spectroscopy via divide-and-conquer semiclassical initial value representation molecular dynamics with application to N-methylacetamide	28-nov-2020	GANDOLFI, MICHELE ; ROGNONI, ALESSANDRO ; AIETA, CHIARA DONATELLA ; CONTE, RICCARDO ; CEOTTO, MICHELE	Article (author)	Open Access
7	Parallel Implementation of Semiclassical Transition State Theory	9-apr-2019	AIETA, CHIARA DONATELLA ; GABAS, FABIO ; CEOTTO, MICHELE	Article (author)	Solo autorizzati
8	Parallel Implementation of Semiclassical Transition State Theory and its application to high-dimensional tunneling reactions	20-giu-2019	AIETA, CHIARA DONATELLA ; GABAS, FABIO ; CEOTTO, MICHELE	Conference Object	Open Access
9	Quantum and Semiclassical Methods for Molecular Rate Constants and Vibrational Spectra Calculations	3-lug-2017	CEOTTO, MICHELE ; AIETA, CHIARA DONATELLA ; GABAS, FABIO ; DI LIBERTO, GIOVANNI ; CONTE, RICCARDO	Conference Object	-
10	QUANTUM AND SEMICLASSICAL METHODS FOR RATE CONSTANT CALCULATIONS	2-feb-2018	AIETA, CHIARA DONATELLA	Doctoral Thesis	Open Access
11	A quantum approximate method for the calculation of thermal reaction rate constants	8-giu-2016	AIETA, CHIARA DONATELLA ; CEOTTO, MICHELE	Conference Object	-
12	A quantum approximate method for the calculation of thermal reaction rate constants	14-giu-2016	AIETA, CHIARA DONATELLA ; CEOTTO, MICHELE	Conference Object	-
13	A quantum method for thermal rate constant calculations from stationary phase approximation of the thermal flux-flux correlation function integral	2017	AIETA, CHIARA DONATELLA ; CEOTTO, MICHELE	Article (author)	Open Access
14	Representing molecular ground and excited vibrational eigenstates with nuclear densities obtained from semiclassical initial value representation molecular dynamics	7-dic-2020	AIETA, CHIARA DONATELLA ; BERTAINA, GIANLUCA ; MICCIARELLI, MARCO ; CEOTTO, MICHELE	Article (author)	Open Access
15	Second generation nitrogen doped titania nanoparticles: a comprehensive electronic and microstructural picture	5-dic-2014	F. Spadavecchia; CEOTTO, MICHELE ; LO PRESTI, LEONARDO ; AIETA, CHIARA DONATELLA ; I. Biraghi; MERONI, DANIELA ; ARDIZZONE, SILVIA ; CAPPELLETTI, GIUSEPPE	Article (author)	riservati
16	Semiclassical Molecular Dynamics : a useful Tool for Spectroscopic Interpretation	11-set-2019	CEOTTO, MICHELE ; CONTE, RICCARDO ; DI LIBERTO, GIOVANNI ; GABAS, FABIO ; MICCIARELLI, MARCO ; AIETA, CHIARA DONATELLA ; BERTAINA, GIANLUCA ; CAZZANIGA, MARCO ; BUCHHOLZ, MAX ; F. Grossmann; SUAREZ CORUJO, JAIME	Conference Object	Open Access
17	Semiclassical molecular dynamics for spectroscopic calculations of high dimensional and condensed phase molecular systems	18-giu-2019	CEOTTO, MICHELE ; CONTE, RICCARDO ; DI LIBERTO, GIOVANNI ; GABAS, FABIO ; MICCIARELLI, MARCO ; AIETA, CHIARA DONATELLA ; BERTAINA, GIANLUCA ; CAZZANIGA, MARCO ; BUCHHOLZ, MAX ; F. Grossmann; SUAREZ CORUJO, JAIME	Conference Object	Open Access
18	Semiclassical “Divide-and-Conquer” Method for Spectroscopic Calculations of High Dimensional Molecular Systems	21-lug-2017	CEOTTO, MICHELE ; CONTE, RICCARDO ; G. D. Liberto; GABAS, FABIO ; BUCHHOLZ, MAX ; AIETA, CHIARA DONATELLA	Conference Object	-
19	Unraveling the cooperative mechanism of visible-light absorption in bulk N,Nb codoped TiO2 powders of nanomaterials	7-ott-2014	C. Marchiori; DI LIBERTO, GIOVANNI ; SOLIVERI, GUIDO ; LOCONTE, LAURA ; LO PRESTI, LEONARDO ; MERONI, DANIELA ; CEOTTO, MICHELE ; OLIVA, CESARE ; CAPPELLI, SERENA ; CAPPELLETTI, GIUSEPPE ; AIETA, CHIARA DONATELLA ; ARDIZZONE, SILVIA	Article (author)	Open Access