Articles with public access mandates - Norge Cruz HernándezLearn more
Available somewhere: 23
New insights into organic–inorganic hybrid perovskite CH 3 NH 3 PbI 3 nanoparticles. An experimental and theoretical study of doping in Pb 2+ sites with Sn 2+, Sr 2+, Cd 2+ and …
J Navas, A Sánchez-Coronilla, JJ Gallardo, NC Hernández, JC Piñero, ...
Nanoscale 7 (14), 6216-6229, 2015
Mandates: Government of Spain
Experimental and theoretical study of the electronic properties of Cu-doped anatase TiO 2
J Navas, A Sánchez-Coronilla, T Aguilar, NC Hernández, ...
Physical Chemistry Chemical Physics 16 (8), 3835-3845, 2014
Mandates: Government of Spain
Porphyrin-based metal-organic frameworks for solar fuel synthesis photocatalysis: band gap tuning via iron substitutions
A Aziz, AR Ruiz-Salvador, NC Hernández, S Calero, S Hamad, ...
Journal of Materials Chemistry A 5 (23), 11894-11904, 2017
Mandates: UK Engineering and Physical Sciences Research Council, European Commission …
Modelling a linker mix‐and‐match approach for controlling the optical excitation gaps and band alignment of zeolitic imidazolate frameworks
R Grau‐Crespo, A Aziz, AW Collins, R Crespo‐Otero, NC Hernández, ...
Angewandte Chemie 128 (52), 16246-16250, 2016
Mandates: UK Engineering and Physical Sciences Research Council, European Commission
Electronic structure of porphyrin-based metal–organic frameworks and their suitability for solar fuel production photocatalysis
S Hamad, NC Hernandez, A Aziz, AR Ruiz-Salvador, S Calero, ...
Journal of Materials Chemistry A 3 (46), 23458-23465, 2015
Mandates: UK Engineering and Physical Sciences Research Council, European Commission …
Simulating key properties of lithium-ion batteries with a fault-tolerant quantum computer
A Delgado, PAM Casares, R Dos Reis, MS Zini, R Campos, ...
Physical Review A 106 (3), 032428, 2022
Mandates: US Department of Defense, Government of Spain
Revealing the role of Pb 2+ in the stability of organic–inorganic hybrid perovskite CH 3 NH 3 Pb 1− x Cd x I 3: an experimental and theoretical study
J Navas, A Sánchez-Coronilla, JJ Gallardo, EI Martín, NC Hernández, ...
Physical Chemistry Chemical Physics 17 (37), 23886-23896, 2015
Mandates: Government of Spain
Thermo-selective Tm x Ti 1− x O 2− x/2 nanoparticles: from Tm-doped anatase TiO 2 to a rutile/pyrochlore Tm 2 Ti 2 O 7 mixture. An experimental and theoretical study with a …
J Navas, A Sánchez-Coronilla, T Aguilar, M Desireé, NC Hernández, ...
Nanoscale 6 (21), 12740-12757, 2014
Mandates: Government of Spain
Electronic and Structural Properties of Highly Aluminum Ion Doped TiO2 Nanoparticles: A Combined Experimental and Theoretical Study
DM de los Santos, T Aguilar, A Sánchez‐Coronilla, J Navas, ...
ChemPhysChem 15 (11), 2267-2280, 2014
Mandates: Government of Spain
The impact of Pd on the light harvesting in hybrid organic-inorganic perovskite for solar cells
J Navas, A Sánchez-Coronilla, JJ Gallardo, JC Piñero, D De los Santos, ...
Nano Energy 34, 141-154, 2017
Mandates: Government of Spain
Draft genome of the marine Gammaproteobacterium Halomonas titanicae
C Sánchez-Porro, RR de la Haba, N Cruz-Hernández, JM González, ...
Genome announcements 1 (2), 10.1128/genomea. 00083-13, 2013
Mandates: Government of Spain
Evolution of octupole deformation and collectivity in neutron-rich lanthanides
K Nomura, R Rodríguez-Guzmán, LM Robledo, JE García-Ramos, ...
Physical Review C 104 (4), 044324, 2021
Mandates: European Commission, Government of Spain
Hybrid Perovskite, CH3NH3PbI3, for Solar Applications: An Experimental and Theoretical Analysis of Substitution in A and B Sites
A Sánchez-Coronilla, J Navas, JJ Gallardo, EI Martín, D De los Santos, ...
Journal of Nanomaterials 2017 (1), 9768918, 2017
Mandates: Government of Spain
Insight of Diversified Reactivity and Theoretical Study of Mixed‐Phase Titanium Dioxide for the Photoactivation of Small Molecules
JO Olowoyo, NC Hernández, M Kumar, SL Jain, JO Babalola, U Kumar
ChemistrySelect 3 (13), 3659-3663, 2018
Mandates: Council of Scientific and Industrial Research, India
Copper–nitroxide based breathing crystals: a unified mechanism of gradual magnetostructural transition supported by quantum chemistry calculations
R Sánchez-de-Armas, NC Hernández, CJ Calzado
Inorganic Chemistry Frontiers 6 (5), 1228-1237, 2019
Mandates: Government of Spain
Hydrogen Bonds in Lead Halide Perovskites: Insights from Ab Initio Molecular Dynamics
A Garrote-Márquez, L Lodeiro, R Suresh, N Cruz Hernández, ...
The Journal of Physical Chemistry C 127 (32), 15901-15910, 2023
Mandates: UK Engineering and Physical Sciences Research Council
Electronic Structure and Magnetic Interactions in the Radical Salt [BEDT-TTF]2[CuCl4]
CJ Calzado, B Rodriguez-Garcia, JR Galan Mascaros, NC Hernández
Inorganic Chemistry 57 (12), 7077-7089, 2018
Mandates: Government of Spain
Nucleation of zeolitic imidazolate frameworks: from molecules to nanoparticles
SRG Balestra, B Martínez-Haya, N Cruz-Hernández, DW Lewis, ...
Nanoscale 15 (7), 3504-3519, 2023
Mandates: Government of Spain
Quadrupole-octupole collectivity in the Xe, Ba, Ce and Nd isotopic chains described with mean field and beyond approaches
R Rodríguez-Guzmán, LM Robledo, K Nomura, NC Hernandez
Journal of Physics G: Nuclear and Particle Physics 49 (1), 015101, 2021
Mandates: Government of Spain
Light‐Induced Spin Transitions in Copper‐Nitroxide‐Based Switchable Molecular Magnets: Insights from Periodic DFT+ U Calculations
R Sánchez‐de‐Armas, N Cruz Hernandez, CJ Calzado
Chemistry–A European Journal 24 (71), 18988-18997, 2018
Mandates: Government of Spain
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