受强制性开放获取政策约束的文章 - Eduard Matito了解详情
无法在其他位置公开访问的文章:9 篇
Overcoming the Failure of Correlation for Out-of-Plane Motions in a Simple Aromatic: Rovibrational Quantum Chemical Analysis of c-C3H2
RC Fortenberry, CM Novak, JP Layfield, E Matito, TJ Lee
Journal of chemical theory and computation 14 (4), 2155-2164, 2018
强制性开放获取政策: US National Aeronautics and Space Administration, Government of Spain
Exploring the relation between intramolecular conjugation and band dispersion in one-dimensional polymers
C García-Fernández, E Sierda, M Abadía, B Bugenhagen, MH Prosenc, ...
The Journal of Physical Chemistry C 121 (48), 27118-27125, 2017
强制性开放获取政策: US Department of Defense, German Research Foundation, Government of Spain
New approximation to the third-order density. Application to the calculation of correlated multicenter indices
F Feixas, M Sola, JM Barroso, JM Ugalde, E Matito
Journal of chemical theory and computation 10 (8), 3055-3065, 2014
强制性开放获取政策: Government of Spain
The aromaticity of dicupra [10] annulenes
R Grande-Aztatzi, JM Mercero, E Matito, G Frenking, JM Ugalde
Physical Chemistry Chemical Physics 19 (14), 9669-9675, 2017
强制性开放获取政策: Government of Spain
Can density functional theory be trusted for high-order electric properties? The case of hydrogen-bonded complexes
R Zalesny, M Medved’, SP Sitkiewicz, E Matito, JM Luis
Journal of Chemical Theory and Computation 15 (6), 3570-3579, 2019
强制性开放获取政策: Government of Spain
Aromaticity descriptors based on electron delocalization
I Casademont-Reig, E Ramos-Cordoba, M Torrent-Sucarrat, E Matito
Aromaticity, 235-259, 2021
强制性开放获取政策: Government of Spain
Benchmark calculations of metal carbonyl cations: relativistic vs. electron correlation effects
E Matito, P Salvador, J Styszyński
Physical Chemistry Chemical Physics 15 (46), 20080-20090, 2013
强制性开放获取政策: Government of Spain
Aromaticity of Organic and Inorganic Heterocycles
F Feixas, J Poater, E Matito, M Sola
Structure, Bonding and Reactivity of Heterocyclic Compounds, 129-160, 2014
强制性开放获取政策: Government of Spain
Excited state dynamics and conjugation effects of the photoisomerization reactions of dihydroazulene
AE Hillers-Bendtsen, FØ Kjeldal, N Ree, E Matito, KV Mikkelsen
Physical Chemistry Chemical Physics 24 (47), 28934-28943, 2022
强制性开放获取政策: Government of Spain
可在其他位置公开访问的文章:70 篇
Quantifying aromaticity with electron delocalisation measures
F Feixas, E Matito, J Poater, M Solà
Chemical Society Reviews 44 (18), 6434-6451, 2015
强制性开放获取政策: European Commission, Government of Spain
An electronic aromaticity index for large rings
E Matito
Physical Chemistry Chemical Physics 18 (17), 11839-11846, 2016
强制性开放获取政策: Government of Spain
Electron delocalization and aromaticity in low-lying excited states of archetypal organic compounds
F Feixas, J Vandenbussche, P Bultinck, E Matito, M Solà
Physical Chemistry Chemical Physics 13 (46), 20690-20703, 2011
强制性开放获取政策: Government of Spain
Separation of dynamic and nondynamic correlation
E Ramos-Cordoba, P Salvador, E Matito
Physical Chemistry Chemical Physics 18 (34), 24015-24023, 2016
强制性开放获取政策: European Commission, Government of Spain
New electron delocalization tools to describe the aromaticity in porphyrinoids
I Casademont-Reig, T Woller, J Contreras-García, M Alonso, ...
Physical Chemistry Chemical Physics 20 (4), 2787-2796, 2018
强制性开放获取政策: Research Foundation (Flanders), Government of Spain
On the existence and characterization of molecular electrides
V Postils, M Garcia-Borràs, M Solà, JM Luis, E Matito
Chemical Communications 51 (23), 4865-4868, 2015
强制性开放获取政策: Government of Spain
All‐Metal Antiaromaticity in Sb4‐Type Lanthanocene Anions
X Min, IA Popov, FX Pan, LJ Li, E Matito, ZM Sun, LS Wang, AI Boldyrev
Angewandte Chemie International Edition 55 (18), 5531-5535, 2016
强制性开放获取政策: US National Science Foundation, 国家自然科学基金委员会, Government of Spain
Performance of DFT functionals for calculating the second-order nonlinear optical properties of dipolar merocyanines
L Lescos, SP Sitkiewicz, P Beaujean, M Blanchard-Desce, B Champagne, ...
Physical Chemistry Chemical Physics 22 (29), 16579-16594, 2020
强制性开放获取政策: National Fund for Scientific Research, Belgium, Agence Nationale de la …
Toward a unique definition of the local spin
E Ramos-Cordoba, E Matito, I Mayer, P Salvador
Journal of chemical theory and computation 8 (4), 1270-1279, 2012
强制性开放获取政策: Hungarian Scientific Research Fund, Government of Spain
Local descriptors of dynamic and nondynamic correlation
E Ramos-Cordoba, E Matito
Journal of Chemical Theory and Computation 13 (6), 2705-2711, 2017
强制性开放获取政策: European Commission, Government of Spain
How Aromatic Are Molecular Nanorings? The Case of a Six‐Porphyrin Nanoring
I Casademont‐Reig, R Guerrero‐Avilés, E Ramos‐Cordoba, ...
Angewandte Chemie 133 (45), 24282-24290, 2021
强制性开放获取政策: Government of Spain
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