Citation Impact
Citing Papers
Toward Point-of-Care Detection of Mycobacterium tuberculosis : A Brighter Solvatochromic Probe Detects Mycobacteria within Minutes
2021 StandoutNobel
Observation of Wave-Packet Branching through an Engineered Conical Intersection
2023 StandoutNobel
The NBO pattern in luminescent chromophores: unravelling excited-state features using TD-DFT
2013
Supramolecular Binding Thermodynamics by Dispersion‐Corrected Density Functional Theory
2012 Standout
Planar vs. twisted intramolecular charge transfer mechanism in Nile Red: new hints from theory
2010
The calculations of excited-state properties with Time-Dependent Density Functional Theory
2012 Standout
Highly efficient organic light-emitting diodes from delayed fluorescence
2012 StandoutNature
Multi-mW, few-cycle mid-infrared continuum spanning from 500 to 2250 cm−1
2017 StandoutNobel
Density functional theory for transition metals and transition metal chemistry
2009
Ab Initio Calculations of Absorption Spectra of Large Molecules in Solution: Coumarin C153
2006
Excited-state calculations with TD-DFT: from benchmarks to simulations in complex environments
2011
Enhanced semiempirical QM methods for biomolecular interactions
2015
Solvation free energies of molecules. The most stable anionic tautomers of uracil
2008 StandoutNobel
Symmetry-dependent solvation of donor-substituted triarylboranes
2008
Non-adiabatic Excited-State Molecular Dynamics: Theory and Applications for Modeling Photophysics in Extended Molecular Materials
2020
Molecular origin of the difference in the HOH bend of the IR spectra between liquid water and ice
2013
Using Time‐Dependent Density Functional Theory to Probe the Nature of Donor–Acceptor Stenhouse Adduct Photochromes
2016
Bipyridine hydrogel for selective and visible detection and absorption of Cd2+
2015
Continuous surface charge polarizable continuum models of solvation. I. General formalism
2010 Standout
Mechanism of Methanol Synthesis on Cu through CO2and CO Hydrogenation
2011 Standout
Supramolecular Hydrogelators and Hydrogels: From Soft Matter to Molecular Biomaterials
2015 Standout
Status and perspectives of CO2 conversion into fuels and chemicals by catalytic, photocatalytic and electrocatalytic processes
2013 Standout
Extensive TD-DFT Benchmark: Singlet-Excited States of Organic Molecules
2009
Non-covalent Interactions of CO2 with Functional Groups of Metal–Organic Frameworks from a CCSD(T) Scheme Applicable to Large Systems
2015
Challenges for Density Functional Theory
2011 Standout
Structural modification strategies for the rational design of red/NIR region BODIPYs
2014 Standout
Recovery of bioactive phenolic compounds from papaya seeds agroindustrial residue using subcritical water extraction
2019 Standout
Carbon capture and conversion using metal–organic frameworks and MOF-based materials
2019 StandoutNobel
Fluorene Analogues of Prodan with Superior Fluorescence Brightness and Solvatochromism
2010
Sustainable Conversion of Carbon Dioxide: An Integrated Review of Catalysis and Life Cycle Assessment
2017 Standout
Design of electrocatalysts for oxygen- and hydrogen-involving energy conversion reactions
2015 Standout
Green extraction processes, biorefineries and sustainability: Recovery of high added-value products from natural sources
2017
Electron Injection from Copper Diimine Sensitizers into TiO2: Structural Effects and Their Implications for Solar Energy Conversion Devices
2015 StandoutNobel
Theoretical Prediction of the Rate Constants for Exciton Dissociation and Charge Recombination to a Triplet State in PCPDTBT with Different Fullerene Derivatives
2014
A Robust and Accurate Tight-Binding Quantum Chemical Method for Structures, Vibrational Frequencies, and Noncovalent Interactions of Large Molecular Systems Parametrized for All spd-Block Elements (Z = 1–86)
2017 Standout
Metal–organic frameworks: functional luminescent and photonic materials for sensing applications
2017 Standout
Increased CO2/N2 selectivity by stepwise fluorination in isoreticular ultramicroporous metal–organic frameworks
2024 StandoutNobel
Green and Sustainable Solvents in Chemical Processes
2018 Standout
Vibrational Spectroscopy as a Probe of Structure and Dynamics in Liquid Water
2009
Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals
2017 Standout
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
2010 Standout
TD-DFT benchmarks: A review
2013
CO2 Capture and Separations Using MOFs: Computational and Experimental Studies
2017
A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution
2006
TD-DFT Assessment of Functionals for Optical 0–0 Transitions in Solvated Dyes
2012
Quantum Mechanical and Experimental Validation that Cyclobis(paraquat‐p‐phenylene) Forms a 1:1 Inclusion Complex with Tetrathiafulvalene
2016 StandoutNobel
The exciton model in molecular spectroscopy
1965 Standout
VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code
2021 Standout
Enhanced Solubility of Polyvinyl Esters in scCO2by Means of Vinyl Trifluorobutyrate Monomer
2014
Selective Formation of End-on Orientation between Polythiophene and Fullerene Mediated by Coordination Nanospaces
2018 StandoutNobel
Toward effective and reliable fluorescence energies in solution by a new state specific polarizable continuum model time dependent density functional theory approach
2007
Quantum Mechanical Continuum Solvation Models
2005 Standout
Revisiting the optical signatures of BODIPY with ab initio tools
2013
GFN2-xTB—An Accurate and Broadly Parametrized Self-Consistent Tight-Binding Quantum Chemical Method with Multipole Electrostatics and Density-Dependent Dispersion Contributions
2019 Standout
Unraveling the Photoswitching Mechanism in Donor–Acceptor Stenhouse Adducts
2016 StandoutNobel
What is Solvatochromism?
2010
On the Computation of Adiabatic Energies in Aza-Boron-Dipyrromethene Dyes
2012
Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions
2009 Standout
Works of Francesca Ingrosso being referenced
A New Glimpse into the CO2‐Philicity of Carbonyl Compounds
2012
Pathways for H2O Bend Vibrational Relaxation in Liquid Water
2009
Solvation Dynamics in Acetonitrile: A Study Incorporating Solute Electronic Response and Nuclear Relaxation
2005
Solvation of Coumarin 153 in Supercritical Fluoroform
2006
Electron Transfer in a Radical Ion Pair: Quantum Calculations of the Solvent Reorganization Energy
2006
Driving Forces Controlling Host–Guest Recognition in Supercritical Carbon Dioxide Solvent
2016
Formation and relaxation of excited states in solution: A new time dependent polarizable continuum model based on time dependent density functional theory
2006
How the Environment Controls Absorption and Fluorescence Spectra of PRODAN: A Quantum-Mechanical Study in Homogeneous and Heterogeneous Media
2007
Ultrafast Energy Transfer from the Intramolecular Bending Vibration to Librations in Liquid Water
2009
Quantum mechanical calculations coupled with a dynamical continuum model for the description of dielectric relaxation: Time dependent Stokes shift of coumarin C153 in polar solvents
2003
Theoretical insights on electron donor–acceptor interactions involving carbon dioxide
2014
Water interactions with hydrophobic groups: Assessment and recalibration of semiempirical molecular orbital methods
2014
A time-dependent polarizable continuum model: Theory and application
2005
Modeling Solvation in Supercritical CO2
2017
A theoretical investigation of the CO2-philicity of amides and carbamides
2013