Daniel J. Arismendi-Arrieta
Daniel J. Arismendi-Arrieta
Verified email at kemi.uu.se - Homepage
Cited by
Cited by
i-TTM Model for Ab Initio-Based Ion–Water Interaction Potentials. 1. Halide–Water Potential Energy Functions
DJ Arismendi-Arrieta, M Riera, P Bajaj, R Prosmiti, F Paesani
The Journal of Physical Chemistry B 120 (8), 1822–1832, 2016
Thermodynamics of Water Dimer Dissociation in the Primary Hydration Shell of the Iodide Ion with Temperature-Dependent Vibrational Predissociation Spectroscopy
CT Wolke, FS Menges, N Tötsch, O Gorlova, JA Fournier, GH Weddle, ...
The Journal of Physical Chemistry A 119 (10), 1859-1866, 2015
Quantum Dynamics of Carbon Dioxide Encapsulated in the Cages of the sI Clathrate Hydrate: Structural Guest Distributions and Cage Occupation
A Valdes, DJ Arismendi-Arrieta, R Prosmiti
The Journal of Physical Chemistry C 119 (8), 3945–3956, 2015
Computational investigations of the thermodynamic properties of size-selected water and Ar–water clusters: high-pressure transitions
A Vítek, DJ Arismendi-Arrieta, R Rodríguez-Cantano, R Prosmiti, ...
Physical Chemistry Chemical Physics 17 (14), 8792-8801, 2015
High Pressure Structural Transitions in Kr Clathrate-Like Clusters
DJ Arismendi-Arrieta, A Vítek, R Prosmiti
The Journal of Physical Chemistry C, 2016
A Systematic Protocol for Benchmarking Guest‐Host Interactions by First‐Principles Computations: Capturing CO2 in Clathrate Hydrates
DJ Arismendi-Arrieta, A Valdés de Luxán, R Prosmiti
Chemistry–A European Journal 24 (37), 9353-9363, 2018
Assessing Intermolecular Interactions in Guest-Free Clathrate Hydrate Systems
I Leon-Merino, R Rodriguez-Segundo, DJ Arismendi-Arrieta, R Prosmiti
The Journal of Physical Chemistry A 122 (5), 1479-1487, 2018
Deformability and solvent penetration in soft nanoparticles at liquid-liquid interfaces
DJ Arismendi-Arrieta, AJ Moreno
Journal of colloid and interface science 570, 212-222, 2020
Simulating liquid water for determining its structural and transport properties
D Arismendi-Arrieta, JS Medina, GS Fanourgakis, R Prosmiti, ...
Applied Radiation and Isotopes 83, 115-121, 2014
He Inclusion in Ice-like and Clathrate-like Frameworks: A Benchmark Quantum Chemistry Study of Guest–Host Interactions
R Yanes-Rodriguez, DJ Arismendi-Arrieta, R Prosmiti
Journal of Chemical Information and Modeling 60 (6), 3043-3056, 2020
Structural Stability of the CO2@sI Hydrate: a Bottom‐Up Quantum Chemistry Approach on the Guest‐Cage and Inter‐Cage Interactions
A Cabrera‐Ramírez, DJ Arismendi‐Arrieta, Á Valdés, R Prosmiti
ChemPhysChem 21 (23), 2618-2628, 2020
Modeling the water-halide ion interactions
DJ Arismendi-Arrieta, R Prosmiti, F Paesani
Journal of Physics: Conference Series 635 (3), 032009, 2015
Exploring CO2@ sI Clathrate Hydrates as CO2 Storage Agents by Computational Density Functional Approaches
A Cabrera-Ramírez, DJ Arismendi-Arrieta, A Valdés, R Prosmiti
ChemPhysChem, 2020
Benchmarking the performance of density-functional-based approaches on intermolecular interactions of Helium–water complexes
MB de Paz, DJA Arrieta, R Prosmiti
Journal of Physics: Conference Series 875 (11), 102026, 2017
Finite Systems under Pressure: Assessing Volume Definition Models from Parallel-Tempering Monte Carlo Simulations
A Vitek, DJ Arismendi-Arrieta, M Sarmanova, R Kalus, R Prosmiti
The Journal of Physical Chemistry A 124 (20), 4036-4047, 2020
Coarsening Kinetics of Complex Macromolecular Architectures in Bad Solvent
M Paciolla, DJ Arismendi-Arrieta, AJ Moreno
Polymers 12 (3), 531, 2020
A bottom-up approach for ion-water interactions: From clusters to bulk
R Rodríguez-Segundo, DJ Arismendi-Arrieta, R Prosmiti
The State of The Art-Reviews on Energetic Ion-Atom and Ion-Molecule …, 2019
Simulations of aqueous systems: from gas to the condensed phase
DJ Arismendi Arrieta
Developing time to frequency-domain descriptors for relaxation processes: Local trends
JS Medina, DJ Arismendi-Arrieta, JV Alemán, R Prosmiti
Journal of Molecular Liquids 245, 62-70, 2017
Development of transferable water-halide potentials
R Rodríguez-Segundo, DJ Arismendi-Arrieta, R Prosmiti
Journal of Physics: Conference Series 875 (11), 102023, 2017
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