statistiche ricercatore

Nome	#
Circularly Polarized Luminescence from Axially Chiral BODIPY DYEmers: An Experimental and Computational Study	170
A fully automated implementation of VPT2 Infrared intensities	122
Communication: One third: A new recipe for the PBE0 paradigm	116
Effective electron displacements: A tool for time-dependent density functional theory computational spectroscopy	101
Calorimetric investigation of the aggregation of lithium perfluorooctanoate on poly (ethyleneglycol) oligomers in water	100
Circular Dichroism and TDDFT Investigation of Chiral Fluorinated Aryl Benzyl Sulfoxides	100
On the Metric of Charge Transfer Molecular Excitations: A Simple Chemical Descriptor	99
On the TD-DFT Accuracy in Determining Single and Double Bonds in Excited-State Structures of Organic Molecules	95
Practical computation of electronic excitation in solution: vertical excitation model	75
The Fate of a Zwitterion in Water from Ab-Initio Molecular Dynamics: Monoethanolamine (MEA)-CO2	74
Structures and Properties of Electronically Excited Chromophores in Solution from the Polarizable Continuum Model Coupled to the Time-Dependent Density Functional Theory	73
Benchmarking Time-Dependent Density Functional Theory for Excited State Geometries of Organic Molecules in Gas-Phase and in Solution	61
Planar versus twisted intramolecular charge transfer mechanism in Nile Red: new hints from theory	58
Totale	1244

	Totale	Lug	Ago	Sett	Ott	Nov	Dic	Gen	Feb	Mar	Apr	Mag	Giu
2017/2018	10	0	0	0	0	0	0	0	0	0	0	10	0
2018/2019	138	0	0	0	0	7	0	37	1	1	20	36	36
2019/2020	278	31	34	11	18	23	26	30	24	28	31	20	2
2020/2021	95	8	4	4	6	8	3	2	10	18	9	6	17
2021/2022	172	0	9	7	4	44	28	3	7	8	4	18	40
2022/2023	208	16	31	21	26	19	43	0	19	33	0	0	0
Totale													1244

CINECA IRIS Institutional Research Information System