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List of works by Hans Ågren

A Fully Conjugated Planar Heterocyclic [9]Circulene

scientific article published on 04 August 2020

Aromaticity of Even-Number Cyclo[<i>n</i>]carbons (<i>n</i> = 6-100)

scientific article published on 10 December 2020

Atomistic description of plasmonic generation in alloys and core shell nanoparticles

scientific article published on 14 December 2020

Benzoselenophenylpyridine platinum complexes: green versus red phosphorescence towards hybrid OLEDs

scientific article published on 01 March 2020

Cognitive Dysfunction among HIV Positive and HIV Negative Patients with Psychosis in Uganda ⬇️

scientific article published on September 6, 2012

Computational Insight into the Binding Profile of the Second-Generation PET Tracer PI2620 with Tau Fibrils

scientific article published on 28 February 2020

Computational study of aromaticity, 1H NMR spectra and intermolecular interactions of twisted thia-norhexaphyrin and its multiply annulated polypyrrolic derivatives

scientific article published on 08 November 2019

Core/Shell NaGdF4:Nd3+/NaGdF4 Nanocrystals with Efficient Near-Infrared to Near-Infrared Downconversion Photoluminescence for Bioimaging Applications ⬇️

scientific article published on March 14, 2012

Cyclo[18]carbon: Insight into Electronic Structure, Aromaticity, and Surface Coupling

scientific article published on 17 October 2019

Different Positron Emission Tomography Tau Tracers Bind to Multiple Binding Sites on the Tau Fibril: Insight from Computational Modeling.

scientific article published on 9 April 2018

Divalent Pseudorotaxane with Polarized Plug-Socket and Padlock Functions

scientific article published on 28 February 2018

Effect of Alzheimer Familial Chromosomal Mutations on the Amyloid Fibril Interaction with Different PET Tracers: Insight from Molecular Modeling Studies.

scientific article published on 12 September 2017

Effect of Familial Mutations on the Interconversion of α-Helix to β-Sheet Structures in an Amyloid-Forming Peptide: Insight from Umbrella Sampling Simulations

scientific article published on 14 January 2019

Efficient Ambient Electrocatalytic Ammonia Synthesis by Nanogold Triggered via Boron Clusters Combined with Carbon Nanotubes

scientific article published on 14 September 2020

Efficient Solar Cells Based on Porphyrin Dyes with Flexible Chains Attached to the Auxiliary Benzothiadiazole Acceptor: Suppression of Dye Aggregation and the Effect of Distortion.

scientific article

Expanded N-Confused Phlorin: A Platform for a Multiply Fused Polycyclic Ring System via Oxidation within the Macrocycle

scientific article published on 28 September 2020

Far-Zone Resonant Energy Transfer in X-ray Photoemission as a Structure Determination Tool.

scientific article published on 31 May 2017

First-principles calculations of anharmonic and deuteration effects on the photophysical properties of polyacenes and porphyrinoids

scientific article published on 01 October 2020

Free Energy Landscape for Alpha-Helix to Beta-Sheet Interconversion in Small Amyloid Forming Peptide under Nanoconfinement

scientific article published on 12 October 2018

Free Energy Profile and Kinetics of Coupled Folding and Binding of the Intrinsically Disordered Protein p53 with MDM2

scientific article published on 26 February 2020

Helicity Inversion of Supramolecular Hydrogels Induced by Achiral Substituents.

scientific article published on 15 November 2017

In silicomodeling and experimental evidence of coagulant protein interaction with precursors for nanoparticle functionalization ⬇️

scientific article published on November 20, 2012

Less is more: on the effect of benzannulation on the solid-state emission of difluoroborates

scientific article published in 2021

Mechanism for the Extremely Efficient Sensitization of Yb3+Luminescence in CsPbCl3 Nanocrystals

scientific article published on 17 January 2019

Microlens array enhanced upconversion luminescence at low excitation irradiance

scientific article published on 17 July 2019

Modeling Near-Edge Fine Structure X-ray Spectra of the Manganese Catalytic Site for Water Oxidation in Photosystem II ⬇️

scientific article published on 03 October 2012

Multidimensional Structure Conformation of Persulfurated Benzene for Highly Efficient Phosphorescence

scientific article published on 29 December 2020

N-Confused Hexapyrrolic Phlorinoid with NIR Absorption: Synthesis, Fusion, Oxidation, and Copper(II) Coordination

scientific article published on 09 December 2020

Nonempirical Simulations of Inhomogeneous Broadening of Electronic Transitions in Solution: Predicting Band Shapes in One- and Two-Photon Absorption Spectra of Chalcones

scientific article published on 30 September 2017

Odd-Number Cyclo[<i>n</i>]Carbons Sustaining Alternating Aromaticity

scientific article published in 2022

One-step solvothermal synthesis of high-emissive amphiphilic carbon dots via rigidity derivation.

scientific article published on 12 December 2017

Plasmonic nano-shells: atomistic discrete interaction versus classic electrodynamics models

scientific article published on 10 June 2020

Role of surface ligands in optical properties of colloidal CdSe/CdS quantum dots ⬇️

scientific article published on February 16, 2011

Solvent Dependence of Structure, Charge Distribution, and Absorption Spectrum in the Photochromic Merocyanine−Spiropyran Pair ⬇️

scientific article published on March 21, 2011

Solvent Polarity-Induced Conformational Unlocking of Asparagine ⬇️

scientific article published on November 13, 2012

Spin-flip time dependent density functional theory applied to excited states with single, double, or mixed electron excitation character ⬇️

scientific article published on September 21, 2010

Spontaneous Decomposition of Fluorinated Phosphorene and Its Stable Structure

scientific article published on 05 November 2019

Structural stability of single-layer PdSe2 with pentagonal puckered morphology and its nanotubes

scientific article published on 14 April 2020

The adsorption of xyloglucan on cellulose: effects of explicit water and side chain variation ⬇️

scientific article published on September 16, 2011

The carbon and oxygen K-edge NEXAFS spectra of CO

scientific article published on 09 July 2020

Theory and Calculation of the Phosphorescence Phenomenon

scientific article published on 7 April 2017

Twisted π-System Chromophores for All-Optical Switching ⬇️

scientific article published on April 7, 2011

Two-Dimensional Gold Halides: Novel Semiconductors with Giant Spin-Orbit Splitting and Tunable Optoelectronic Properties

scientific article published on 03 November 2020

Ultraefficient Singlet Oxygen Generation from Manganese-Doped Cesium Lead Chloride Perovskite Quantum Dots

scientific article published on 17 August 2020

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