Mariagrazia Fortino

università magna graecia di catanzaro

H指数:14

被引数:538

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Optical Properties of Chiral Perovskites: The Role of Electrostatic Embedding in Correcting the Accuracy of Exchange-Correlation Functionals

手性钙钛矿的光学性质：静电嵌入在修正交换-相关泛函精度中的作用

The Journal of Physical Chemistry Letters

IF0

2026-03-160

PRE

Ultrafast Excited-State Dynamics of a Porphyrin–OPE Conjugate: Energy Transfer and Aggregation Effects

卟啉-偶极子聚乙炔共轭体的超快激发态动力学：能量转移和聚集效应

The Journal of Physical Chemistry C

IF3.2

2025-11-260

OAAI

Stepwise kinetics of the early-stage nucleation in chiral perovskites via ab initio molecular dynamics and free-energy calculations

NANOSCALE

IF5.1

2025-01-010

Complementing Adiabatic and Nonadiabatic Methods To Understand Internal Conversion Dynamics in Porphyrin Derivatives

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-12-110

PRE

Distinctive Chiral Conformations Induced to Poly (naphthalene-1,4-diyl) by Helix-sense-selective Polymerization and Circularly Polarized Light Irradiation

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2024-05-030

PRE

BDNF- and VEGF-Responsive Stimulus to an NGF Mimic Cyclic Peptide with Copper Ionophore Capability and Ctr1/CCS-Driven Signaling

ACS CHEMICAL NEUROSCIENCE

IF3.9

2024-04-112

PRE

Molecular ordering-enhanced circularly polarized luminescence of chiral 1,10-phenanthroline derivatives

CHEMICAL COMMUNICATIONS

IF4.2

2024-01-012

PRE

Chiral self-organization of the TPPS4 porphyrin assisted by molecular rotations

MOLECULAR SYSTEMS DESIGN & ENGINEERING

IF3.2

2023-01-012

PRE

Atomistic modeling of metal-ligand chirality transfer and chiroptical properties of lead and tin hybrid perovskites

JOURNAL OF MATERIALS CHEMISTRY C

IF5.1

2023-01-0111

PRE

Neurotrophic Activity and Its Modulation by Zinc Ion of a Dimeric Peptide Mimicking the Brain-Derived Neurotrophic Factor N-Terminal Region

神经营养活性及其通过模仿脑源性神经营养因子N端区域的二聚体肽的锌离子的调节

ACS CHEMICAL NEUROSCIENCE

IF3.9

2022-11-086

OAAI

Non-uniform Self-folding of Helical Poly(fluorenevinylene) Derivatives in the Solid State Leading to Amplified Circular Dichroism and Circularly Polarized Light Emission

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

IF16.9

2022-09-2710

PRE

Multinuclear Metal-Binding Ability of the N-Terminal Region of Human Copper Transporter Ctr1: Dependence Upon pH and Metal Oxidation State

FRONTIERS IN MOLECULAR BIOSCIENCES

IF4

2022-05-0510

OAAI

Multi-replica biased sampling for photoswitchable π-conjugated polymers

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2021-05-0514

OAAI

Unraveling the internal conversion process within the Q-bands of a chlorophyll-like-system through surface-hopping molecular dynamics simulations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2021-03-0216

OAAI

Combined Experimental and Computational Approach toward the Structural Design of Borosilicate-Based Bioactive Glasses

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2020-07-1629

PREAI

Assessment of interatomic parameters for the reproduction of borosilicate glass structures via DFT-GIPAW calculations

JOURNAL OF THE AMERICAN CERAMIC SOCIETY

IF3.8

2019-06-2534

OAAI

The role of the halogen bond in iodothyronine deiodinase: Dependence on chalcogen substitution in naphthyl-based mimetics

卤素键在碘代甲状腺素脱碘酶中的作用: 对基于萘基的模拟物中硫属元素取代的依赖性

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2019-01-2516

PREAI

Mechanism of Thyroxine Deiodination by Naphthyl-Based Iodothyronine Deiodinase Mimics and the Halogen Bonding Role: A DFT Investigation

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2015-04-2315

OAAI

Strain-Induced Interlayer Interactions under Hydrostatic Pressure Can Boost Circularly Polarized Luminescence in Chiral Hybrid Halide Perovskites

静水压力下应变诱导的层间相互作用可增强手性杂化卤化物钙钛矿的圆偏振发光

The Journal of Physical Chemistry Letters

IF0

OAAI

Mariagrazia Fortino

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