statistiche ricercatore

Nome	#
Accurate Structures and Rotational Constants of Steroid Hormones at DFT Cost: Androsterone, Testosterone, Estrone, β-Estradiol, and Estriol	58
Reduced Cost Computation and Exploitation of Accurate Radial Interaction Potentials for Barrier-Less Processes	52
Accurate structures and rotational constants of bicyclic monoterpenes at DFT cost by means of the bond-corrected Pisa composite scheme (BPCS)	44
Ultrafast photo-induced processes in complex environments : the role of accuracy in excited-state energy potentials and initial conditions	36
Reconciling Accuracy and Feasibility for Barrierless Reaction Steps by the PCS/DDCI/MC-PDFT Protocol: Methane and Ethylene Dissociations as Case Studies	32
Toward an accurate black-box tool for the kinetics of gas-phase reactions involving barrier-less elementary steps	30
Tuning ultrafast time-evolution of photo-induced charge-transfer states : a real-time electronic dynamics study in substituted indenotetracene derivatives	29
Electronic and Vibrational Manifold of Tetracyanoethylene-Chloronaphthalene Charge Transfer Complex in Solution: Insights from TD-DFT and Ab Initio Molecular Dynamics	27
Structures and Rotational Constants of Monocyclic Monoterpenes at DFT Cost by Pisa Composite Schemes and Vibrational Perturbation Theory	14
Molecular structures with spectroscopic accuracy at DFT cost by the templating synthon approach and the PCS141 database	11
Totale	333

	Totale	Lug	Ago	Sett	Ott	Nov	Dic	Gen	Feb	Mar	Apr	Mag	Giu
2024/2025	333	0	0	2	4	60	18	13	5	67	35	62	67
Totale													333