Lista de obras - Jonas Elm - Dominio Público Uruguay

Ambient reaction kinetics of atmospheric oxygenated organics with the OH radical: a computational methodology study ⬇️

artículo científico publicado el 28 de junio de 2013

Aromaticity-Controlled Energy Storage Capacity of the Dihydroazulene-Vinylheptafulvene Photochromic System.

artículo científico publicado en 2016

Assessment of Density Functional Theory in Predicting Structures and Free Energies of Reaction of Atmospheric Prenucleation Clusters.

artículo científico publicado en 2012

Assessment of binding energies of atmospherically relevant clusters

artículo científico publicado en 2013

Atmospheric Fate of Monoethanolamine: Enhancing New Particle Formation of Sulfuric Acid as an Important Removal Process

artículo científico publicado en 2017

Atmospheric Oxidation of Piperazine Initiated by ·Cl: Unexpected High Nitrosamine Yield

artículo científico publicado en 2018

Atmospheric chemistry of iodine anions: elementary reactions of I, IO, and IO with ozone studied in the gas-phase at 300 K using an ion trap

artículo científico publicado en 2018

Azulenium chemistry: towards new derivatives of photochromic dihydroazulenes

artículo científico publicado en 2016

Basis set convergence of the binding energies of strongly hydrogen-bonded atmospheric clusters.

artículo científico publicado en 2016

Benchmark Study of the Structural and Thermochemical Properties of a Dihydroazulene/Vinylheptafulvene Photoswitch.

artículo científico publicado en 2017

Benchmarking sampling methodology for calculations of Rayleigh light scattering properties of atmospheric molecular clusters

scientific article published on 26 July 2019

Can COSMOTherm Predict a Salting in Effect?

artículo científico publicado en 2017

Closed-Shell Organic Compounds Might Form Dimers at the Surface of Molecular Clusters

artículo científico publicado en 2018

Computational Methodology Study of the Optical and Thermochemical Properties of a Molecular Photoswitch

article by Stine T. Olsen et al published 21 January 2015 in Journal of Physical Chemistry A

Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid

artículo científico publicado en 2015

Computational Study of the Effect of Glyoxal–Sulfate Clustering on the Henry’s Law Coefficient of Glyoxal

artículo científico publicado en 2014

Computational study of the Rayleigh light scattering properties of atmospheric pre-nucleation clusters

artículo científico publicado en 2014

Contribution of Methanesulfonic Acid to the Formation of Molecular Clusters in the Marine Atmosphere

artículo científico publicado en 2022

Coupled Cluster Evaluation of the Stability of Atmospheric Acid-Base Clusters with up to 10 Molecules

artículo científico publicado en 2016

Density functional theory basis set convergence of sulfuric acid-containing molecular clusters

Diamines Can Initiate New Particle Formation in the Atmosphere.

artículo científico publicado en 2017

Direct probing of ion pair formation using a symmetric triangulenium dye

artículo científico publicado en 2011

Effect of Bisulfate, Ammonia, and Ammonium on the Clustering of Organic Acids and Sulfuric Acid

artículo científico publicado en 2017

Effect of Conformers on Free Energies of Atmospheric Complexes.

artículo científico publicado en 2016

Elucidating the Limiting Steps in Sulfuric Acid-Base New Particle Formation

artículo científico publicado en 2017

Formation of atmospheric molecular clusters consisting of sulfuric acid and C8H12O6 tricarboxylic acid.

artículo científico publicado en 2017

Gas-phase spectroscopy of a vinylheptafulvene chromophore

artículo científico publicado en 2015

Glyoxal and Methylglyoxal Setschenow Salting Constants in Sulfate, Nitrate, and Chloride Solutions: Measurements and Gibbs Energies.

artículo científico publicado en 2015

Guanidine - A Highly Efficient Stabilizer in Atmospheric New-Particle Formation.

artículo científico publicado en 2018

Hydration of Atmospheric Molecular Clusters II: Organic Acid-Water Clusters

article

Hydration of Atmospheric Molecular Clusters: Systematic Configurational Sampling

Influence of nucleation precursors on the reaction kinetics of methanol with the OH radical.

artículo científico publicado en 2013

Interaction of glycine with common atmospheric nucleation precursors

artículo científico publicado en 2013

Large area, soft crystalline thin films of N,N′,N′′-trialkyltriazatriangulenium salts with homeotropic alignment of the discotic cores in a lamellar lattice

Methanesulfonic Acid-driven New Particle Formation Enhanced by Monoethanolamine: A Computational Study

scientific article published on 22 November 2019

Molecular interaction of pinic acid with sulfuric acid: exploring the thermodynamic landscape of cluster growth

artículo científico publicado en 2014

Neutral Sulfuric Acid-Water Clustering Rates: Bridging the Gap between Molecular Simulation and Experiment

artículo científico publicado en 2020

Obtaining enhanced circular dichroism in [4]heterohelicenium analogues

artículo científico publicado en 2012

Phosphoric acid – a potentially elusive participant in atmospheric new particle formation

Piperazine Enhancing Sulfuric Acid-Based New Particle Formation: Implications for the Atmospheric Fate of Piperazine

artículo científico publicado en 2019

Racemization mechanisms and electronic circular dichroism of [4]heterohelicenium dyes: a theoretical study

artículo científico publicado en 2011

Rayleigh light scattering properties of atmospheric molecular clusters consisting of sulfuric acid and bases

scientific article published on 26 March 2015

Reply to the 'Comment on "Atmospheric chemistry of iodine anions: elementary reactions of I-, IO-, and IO with ozone studied in the gas-phase at 300 K using an ion trap"' by D. Britz, Phys. Chem. Chem. Phys., 2019, 21, C9CP03851E

artículo científico publicado en 2019

Strong Even/Odd Pattern in the Computed Gas-Phase Stability of Dicarboxylic Acid Dimers: Implications for Condensation Thermodynamics

scientific article published on 28 October 2019

Strong Hydrogen Bonded Molecular Interactions between Atmospheric Diamines and Sulfuric Acid

artículo científico publicado en 2016

Structural Effects of Amines in Enhancing Methanesulfonic Acid-Driven New Particle Formation

artículo científico publicado en 2020

The Effect of Water and Bases on the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Sulfuric Acid

artículo científico publicado en 2016

The reaction of hydrated iodide I(H2O)- with ozone: a new route to IO2- products

artículo científico publicado en 2019

The reaction of isotope-substituted hydrated iodide I(HO)- with ozone: the reactive influence of the solvent water molecule

artículo científico publicado en 2020

The role of highly oxygenated organic molecules in the Boreal aerosol-cloud-climate system

artículo científico publicado en 2019

Theoretical Investigation of Substituent Effects on the Dihydroazulene/Vinylheptafulvene Photoswitch: Increasing the Energy Storage Capacity.

artículo científico publicado en 2016

Toward a Holistic Understanding of the Formation and Growth of Atmospheric Molecular Clusters: A Quantum Machine Learning Perspective

artículo científico publicado en 2020

Towards Solar Energy Storage in the Photochromic Dihydroazulene-Vinylheptafulvene System

artículo científico publicado en 2015

Unexpected Growth Coordinate in Large Clusters Consisting of Sulfuric Acid and C8H12O6 Tricarboxylic Acid

scientific article published on 28 March 2019

What Is Required for Highly Oxidized Molecules To Form Clusters with Sulfuric Acid?

artículo científico publicado en 2017

Lista de obras de Jonas Elm

Ambient reaction kinetics of atmospheric oxygenated organics with the OH radical: a computational methodology study ⬇️

Aromaticity-Controlled Energy Storage Capacity of the Dihydroazulene-Vinylheptafulvene Photochromic System.

Assessment of Density Functional Theory in Predicting Structures and Free Energies of Reaction of Atmospheric Prenucleation Clusters.

Assessment of binding energies of atmospherically relevant clusters

Atmospheric Fate of Monoethanolamine: Enhancing New Particle Formation of Sulfuric Acid as an Important Removal Process

Atmospheric Oxidation of Piperazine Initiated by ·Cl: Unexpected High Nitrosamine Yield

Atmospheric chemistry of iodine anions: elementary reactions of I, IO, and IO with ozone studied in the gas-phase at 300 K using an ion trap

Azulenium chemistry: towards new derivatives of photochromic dihydroazulenes

Basis set convergence of the binding energies of strongly hydrogen-bonded atmospheric clusters.

Benchmark Study of the Structural and Thermochemical Properties of a Dihydroazulene/Vinylheptafulvene Photoswitch.

Benchmarking sampling methodology for calculations of Rayleigh light scattering properties of atmospheric molecular clusters

Can COSMOTherm Predict a Salting in Effect?

Closed-Shell Organic Compounds Might Form Dimers at the Surface of Molecular Clusters

Computational Methodology Study of the Optical and Thermochemical Properties of a Molecular Photoswitch

Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid

Computational Study of the Effect of Glyoxal–Sulfate Clustering on the Henry’s Law Coefficient of Glyoxal

Computational study of the Rayleigh light scattering properties of atmospheric pre-nucleation clusters

Contribution of Methanesulfonic Acid to the Formation of Molecular Clusters in the Marine Atmosphere

Coupled Cluster Evaluation of the Stability of Atmospheric Acid-Base Clusters with up to 10 Molecules

Density functional theory basis set convergence of sulfuric acid-containing molecular clusters

Diamines Can Initiate New Particle Formation in the Atmosphere.

Direct probing of ion pair formation using a symmetric triangulenium dye

Effect of Bisulfate, Ammonia, and Ammonium on the Clustering of Organic Acids and Sulfuric Acid

Effect of Conformers on Free Energies of Atmospheric Complexes.

Elucidating the Limiting Steps in Sulfuric Acid-Base New Particle Formation

Formation of atmospheric molecular clusters consisting of sulfuric acid and C8H12O6 tricarboxylic acid.

Gas-phase spectroscopy of a vinylheptafulvene chromophore

Glyoxal and Methylglyoxal Setschenow Salting Constants in Sulfate, Nitrate, and Chloride Solutions: Measurements and Gibbs Energies.

Guanidine - A Highly Efficient Stabilizer in Atmospheric New-Particle Formation.

Hydration of Atmospheric Molecular Clusters II: Organic Acid-Water Clusters

Hydration of Atmospheric Molecular Clusters: Systematic Configurational Sampling

Influence of nucleation precursors on the reaction kinetics of methanol with the OH radical.

Interaction of glycine with common atmospheric nucleation precursors

Large area, soft crystalline thin films of N,N′,N′′-trialkyltriazatriangulenium salts with homeotropic alignment of the discotic cores in a lamellar lattice

Methanesulfonic Acid-driven New Particle Formation Enhanced by Monoethanolamine: A Computational Study

Molecular interaction of pinic acid with sulfuric acid: exploring the thermodynamic landscape of cluster growth

Neutral Sulfuric Acid-Water Clustering Rates: Bridging the Gap between Molecular Simulation and Experiment

Obtaining enhanced circular dichroism in [4]heterohelicenium analogues

Phosphoric acid – a potentially elusive participant in atmospheric new particle formation

Piperazine Enhancing Sulfuric Acid-Based New Particle Formation: Implications for the Atmospheric Fate of Piperazine

Racemization mechanisms and electronic circular dichroism of [4]heterohelicenium dyes: a theoretical study

Rayleigh light scattering properties of atmospheric molecular clusters consisting of sulfuric acid and bases

Reply to the 'Comment on "Atmospheric chemistry of iodine anions: elementary reactions of I-, IO-, and IO with ozone studied in the gas-phase at 300 K using an ion trap"' by D. Britz, Phys. Chem. Chem. Phys., 2019, 21, C9CP03851E

Strong Even/Odd Pattern in the Computed Gas-Phase Stability of Dicarboxylic Acid Dimers: Implications for Condensation Thermodynamics

Strong Hydrogen Bonded Molecular Interactions between Atmospheric Diamines and Sulfuric Acid

Structural Effects of Amines in Enhancing Methanesulfonic Acid-Driven New Particle Formation

The Effect of Water and Bases on the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Sulfuric Acid

The reaction of hydrated iodide I(H2O)- with ozone: a new route to IO2- products

The reaction of isotope-substituted hydrated iodide I(HO)- with ozone: the reactive influence of the solvent water molecule

The role of highly oxygenated organic molecules in the Boreal aerosol-cloud-climate system

Theoretical Investigation of Substituent Effects on the Dihydroazulene/Vinylheptafulvene Photoswitch: Increasing the Energy Storage Capacity.

Toward a Holistic Understanding of the Formation and Growth of Atmospheric Molecular Clusters: A Quantum Machine Learning Perspective

Towards Solar Energy Storage in the Photochromic Dihydroazulene-Vinylheptafulvene System

Unexpected Growth Coordinate in Large Clusters Consisting of Sulfuric Acid and C8H12O6 Tricarboxylic Acid

What Is Required for Highly Oxidized Molecules To Form Clusters with Sulfuric Acid?