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Mireia Via-Nadal
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Year
Benchmarking density functional methods for calculation of state energies of first row spin-crossover molecules
J Cirera, M Via-Nadal, E Ruiz
Inorganic chemistry 57 (22), 14097-14105, 2018
1462018
Comprehensive benchmarking of density matrix functional approximations
M Rodríguez-Mayorga, E Ramos-Cordoba, M Via-Nadal, M Piris, E Matito
Physical Chemistry Chemical Physics 19 (35), 24029-24041, 2017
442017
Singling out dynamic and nondynamic correlation
M Via-Nadal, M Rodríguez-Mayorga, E Ramos-Cordoba, E Matito
The Journal of Physical Chemistry Letters 10 (14), 4032-4037, 2019
34*2019
Macromolecular crowding upon in-vivo-like enzyme-kinetics: effect of enzyme-obstacle size ratio
C Balcells Nadal, I Pastor, L Pitulice, C Hernández, M Via Nadal, ...
New Frontiers in Chemistry, 2015, vol. 24, num. 1, p. 3-16, 2015
27*2015
Brownian dynamics computational model of protein diffusion in crowded media with dextran macromolecules as obstacles
PM Blanco, M Via, JL Garcés, S Madurga, F Mas
Entropy 19 (3), 105, 2017
242017
Salient signature of van der Waals interactions
M Via-Nadal, M Rodríguez-Mayorga, E Matito
Physical Review A 96 (5), 050501, 2017
162017
Electron-pair distribution in chemical bond formation
M Rodríguez-Mayorga, M Via-Nadal, M Solà, JM Ugalde, X Lopez, ...
The Journal of Physical Chemistry A 122 (7), 1916-1923, 2018
82018
Natural range separation of the Coulomb hole
M Via-Nadal, M Rodríguez-Mayorga, E Ramos-Cordoba, E Matito
The Journal of chemical physics 156 (18), 2022
32022
Electron correlation in density matrices and Coulomb holes
M Via Nadal
2020
Brownian dynamics computational model of protein diffusion in crowded media with dextran macromolecules as obstacles
PM Blanco Andrés, M Via Nadal, JL Garcés, S Madurga Díez, ...
Entropy, 2017, vol. 19, num. 3, p. 105, 2017
2017
Spin-crossover transition metal complexes as candidates to single-molecule devices.
M Via Nadal
2014
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Articles 1–11