My current research interests reside in the study of linear and non-linear optical properties of organic molecules, environmental effects on biological chromophores, optical and magnetic properties of transition metal clusters and endohedral silicon cages, and topological insulators.
I am also involved in the development of scientific software: a relativistic atomic solver and pseudo-potential generator (APE - atomic pseudo-potential engine), and a code that solves the (time-dependent) Kohn-Sham equations in order to obtain the response of an electronic system to an external perturbation (octopus).
Research Highlights
- Insights into colour-tuning of chlorophyll optical response in green plants
J. Jornet-Somoza, J. Alberdi-Rodriguez, Bruce F. Milne, X. Andrade, M.A.L. Marques, F. Nogueira, M.J.T. Oliveira, J.J.P. Stewart, A. Rubio
Phys. Chem. Chem. Phys. 17, 26599-26606 (2015) - Materials Design On-the-Fly
Tiago F. T. Cerqueira, Rafael Sarmiento-Pérez, Maximilian Amsler, F. Nogueira, Silvana Botti, Miguel A. L. Marques
J. Chem. Theory Comput. 11, 3955-3960 (2015) - Accurate Color Tuning of Firefly Chromophore by Modulation of Local Polarization Electrostatic Fields
Duanjun Cai, Miguel A. L. Marques, Fernando Nogueira
The Journal of Physical Chemistry B 115, 329-332 (2011)
Publications [LaTeX]
Books
Chapters of Books
1 - A Tutorial on Density Functional Theory
F. Nogueira, A. Castro, and M.A.L. Marques
in A Primer in Density-Functional Theory, C. Fiolhais, F. Nogueira, and M.A.L. Marques (ed.), Lecture Notes in Physics, Vol. 620, Springer, Berlin, 218-256 (2003)
Edited
2 - Topical issue: Special issue in honor of Hardy Gross
Miguel A.L. Marques, Fernando Nogueira, Angel Rubio, Carsten A. Ullrich (Eds.)
The European Physical Journal B 91, 297 (2018)
3 - Fundamentals of Time-Dependent Density-Functional Theory
Miguel A. L. Marques, Neepa T. Maitra, Fernando Nogueira, Eberhard K. U. Gross, Angel Rubio (Eds.)
Lecture Notes in Physics (Springer, Berlin) 837 (2012)
4 - Time-Dependent Density Functional Theory
M.A.L. Marques, C. Ullrich, F. Nogueira, A. Rubio, K. Burke, and E.K.U. Gross (Eds.)
Lecture Notes in Physics (Springer, Berlin) 706 (2006)
5 - A Primer in Density-Functional Theory
C. Fiolhais, F. Nogueira, and M.A.L. Marques (Eds.)
Lecture Notes in Physics (Springer, Berlin) 620 (2003)
Papers
International Journals
6 - High-refractive-index materials screening from machine learning and ab initio methods
Pedro J.M.A. Carriço, Márcio Ferreira, Tiago F.T. Cerqueira, Fernando Nogueira, Pedro Borlido
Phys. Rev. Mater. 8, 015201 (2024)
7 - Structural diversity in conducting bilayer salts (CNB-EDT-TTF)4A
Isabel. C. Santos, Vasco Gama, Sandra Rabaça, Luís F. Veiros, Fernando Nogueira, José A. Paixão, Manuel Almeida
Cryst. Eng. Comm. 22, 8313 (2020)
8 - Field-dependent electrical properties of carbon nanotubes from first-principles: negative differential conductance, current oscillations and molecular sensing
Jaime Silva, B. F. Milne, F. Nogueira
J. Phys.-Condes. Matter 32, 135502 (2020)
9 - On the Single Wall Carbon Nanotube Surface Plasmon Stability
Jaime Silva, B. F. Milne, F. Nogueira
EPJ Web Conf. 233, 05009 (2020)
10 - Structural, morphological, Raman and ac electrical properties of the multiferroic sol-gel made Bi0.8Er0.1Ba0.1Fe0.96Cr0.02Co0.02O3 material
A Benali, BMG Melo, PR Prezas, M Bejar, E Dhahri, MA Valente, MPF Graca, BA Nogueira, BFO Costa
J. Alloys Compd. 775, 304-315 (2019)
11 - On the ordeal of quinolone preparation via cyclisation of aryl-enamines; synthesis and structure of ethyl 6-methyl-7-iodo-4-(3-iodo-4-methylphenoxy)-quinoline-3-carboxylate
P Horta, MSC Henriques, EM Bras, F Murtinheira, F Nogueira, PM O Neill, JA Paixao, R Fausto, MLS Cristiano
Pure Appl. Chem. 89, 765-780 (2017)
12 - High-throughput search of ternary chalcogenides for p-type transparent electrodes
Jingming Shi, Tiago F.T. Cerqueira, Wenwen Cui, Fernando Nogueira, Silvana Botti, Miguel A.L. Marques
Scientific Reports 7, 43179 (2017)
13 - Finite-Size Effects in the Absorption Spectra of a Single-Wall Carbon Nanotube
Jaime Silva, Micael J. T. Oliveira, Senentxu Lanceros-Mendez, Fernando Nogueira
J. Phys. Chem. C 120, 18268-18274 (2016)
14 - Quinolone-Hydroxyquinoline Tautomerism in Quinolone 3-Esters. Preserving the 4-Oxoquinoline Structure To Retain Antimalarial Activity
P Horta, N Kus, MSC Henriques, JA Paixao, L Coelho, F Nogueira, PM O´Neill
J. Org. Chem. 80(24), 12244-12257 (2015)
15 - Insights into colour-tuning of chlorophyll optical response in green plants
J. Jornet-Somoza, J. Alberdi-Rodriguez, Bruce F. Milne, X. Andrade, M.A.L. Marques, F. Nogueira, M.J.T. Oliveira, J.J.P. Stewart, A. Rubio
Phys. Chem. Chem. Phys. 17, 26599-26606 (2015)
16 - Synthesis, structure, theoretical studies and luminescent properties of a ternary erbium(III) complex with acetylacetone and bathophenanthroline ligands
Pablo Martín-Ramos, Pedro S. Pereira Silva, Pedro Chamorro-Posada, Manuela Ramos Silva, Bruce F. Milne, Fernando Nogueira, Jesús Martín-Gil
Journal of Luminescence 162, 42-49 (2015)
17 - Materials Design On-the-Fly
Tiago F. T. Cerqueira, Rafael Sarmiento-Pérez, Maximilian Amsler, F. Nogueira, Silvana Botti, Miguel A. L. Marques
J. Chem. Theory Comput. 11, 3955-3960 (2015)
18 - Materials design on-the-fly
Tiago F.T. Cerqueira, Rafael Sarmiento-Pérez, Maximilian Amsler, F. Nogueira, Silvana Botti, Miguel A.L. Marques
Journal of Chemical Theory and Computation 11, 3955-3960 (2015)
19 - Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems
X. Andrade, D.A. Strubbe, U. de Giovannini, A.H. Larsen, M.J.T. Oliveira, J. Alberdi-Rodriguez, A. Varas, I. Theophilou, N. Helbig, M. Verstraete, L. Stella, F. Nogueira, A. Aspuru-Guzik, A. Castro. M.A.L. Marques, A. Rubio
Phys. Chem. Chem. Phys. 17, 31371-31396 (2015)
20 - Optical and Magnetic Excitations of Metal-Encapsulating Si Cages: A Systematic Study by Time-Dependent Density Functional Theory
M.J.T. Oliveira, P.V.C. Medeiros, J.R.F. Sousa, F. Nogueira, G.K. Gueorguiev
J. Phys. Chem. C 118, 11377-11384 (2014)
21 - Theoretical study of heavy-atom tuning of nonlinear optical properties in group 15 derivatives of N,N,N-trimethylglycine (betaine)
Bruce F. Milne, Fernando Nogueira and Cláudia Cardoso
Dalton Transactions 42, 3695-3703 (2013)
22 - Marine natural products from the deep Pacific as potential non-linear optical chromophores
Bruce F. Milne, Patrick Norman, Fernando Nogueira and Cláudia Cardoso
Phys. Chem. Chem. Phys. 15, 14814-14822 (2013)
23 - Full Color Modulation of Firefly Luciferase through Engineering with Unified Stark Effect
Duanjun Cai, Miguel Alexandre Lopes Marques, Fernando Nogueira
J. Phys. Chem. B 117, 13725-13730 (2013)
24 - On the influence of water on the electronic structure of firefly oxyluciferin anions from absorption spectroscopy of bare and monohydrated ions in vacuo
Kristian Støchkel, ChristianHansen, Jørgen Houmøller, Lisbeth Nielsen, Kelvin Anggara, Mathieu Linares, Patrick Norman, Fernando Nogueira, Oleg Maltsev, Lukas Hintermann, Steen Brøndsted Nielsen, Pance Naumov, Bruce F. Milne
J. Am. Chem. Soc. 135, 6485-6493 (2013)
25 - TDDFT in massively parallel computer architectures: the octopus project
X. Andrade, J. Alberdi-Rodriguez, D.A. Strubbe, M.J.T. Oliveira, F. Nogueira, A. Castro, J. Muguerza, A. Arruabarrena, S.G. Louie, A. Aspuru-Guzik, A. Rubio, M.A.L. Marques
J. Phys.: Condens. Matter 24, 233202 (2012)
26 - Accurate Color Tuning of Firefly Chromophore by Modulation of Local Polarization Electrostatic Fields
Duanjun Cai, Miguel A. L. Marques, Fernando Nogueira
The Journal of Physical Chemistry B 115, 329-332 (2011)
27 - Fragment molecular orbital investigation of the role of AMP protonation in firefly luciferase pH-sensitivity
Bruce F. Milne, Miguel A. L. Marques and Fernando Nogueira
Physical Chemistry Chemical Physics 12, 14285-14293 (2010)
28 - Computational Study of Molecules with High Intrinsic Hyperpolarizabilities
Cláudia Cardoso, Paulo E. Abreu, Bruce F. Milne and Fernando Nogueira
The Journal of Physical Chemistry A 114 (39), 10676-10683 (2010)
29 - Bioheterojunction Effect on Fluorescence Origin and Efficiency Improvement of Firefly Chromophores
Duanjun Cai, Miguel A. L. Marques, Bruce F. Milne and Fernando Nogueira
The Journal of Physical Chemistry Letters 1 (19), 2781-2787 (2010)
30 - Structure Dependence of Hyperpolarizability in Octopolar Molecules
C. Cardoso and P. E. Abreu and F. Nogueira
J. Chem. Theory Comput. 5, 850-858 (2009)
31 - Photoabsorption Spectra of Small Cationic Xenon Clusters from Time-Dependent Density Functional Theory
M.J.T. Oliveira, F. Nogueira, M.A.L. Marques, Angel Rubio
J. Chem. Phys. 131, 214302 (2009)
32 - Experimental and ab-initio studies of the spectroscopic properties of N, N , N triphenylguanidine and N, N , N triphenylguanidinium chloride
C. Cardoso, P. S. Pereira Silva, M. Ramos Silva, A. Matos Beja, J. A. Paixão, F. Nogueira, A. J. F. N. Sobral
Journal of Molecular Structure 878, 169-176 (2008)
33 - Density Functional Theory study of the structure and NMR chemical shifts in peroxovanadium (V) complexes of L-lactic acid
L. Justino, M. L. Ramos, A. Sobral, M. Kaupp, F. Nogueira, H. Burrougs, C. Fiolhais and V. M. S. Gil
Inorganic Chemistry 47(16), 7317-7326 (2008)
34 - Oxoperoxo vanadium(V) complexes of L-lactic acid: Density functional theory study of structure and NMR chemical shifts
Licinia L. G. Justino, M. Luisa Ramos, Fernando Nogueira, Abilio J. F. N. Sobral, Carlos F. G. C. Geraldes, Martin Kaupp, Hugh D. Burrows, Carlos Fiolhais, and Victor M. S. Gil
Inorganic Chemistry 47, 7317-7326 (2008)
35 - Generating relativistic pseudo-potentials with explicit incorporation of semi-core states using APE, the Atomic Pseudo-potentials Engine
Micael Oliveira, Fernando Nogueira
Computer Physics Communications 178, 524-534 (2008)
36 - Density functional and X-ray diffraction studies of two polymorphs of N, N , N -triphenylguanidine
P.S.P. Silva, C. Cardoso, M.R. Silva, J.A. Paixão, A.M. Beja, F. Nogueira
Journal of Molecular Structure 888, 92-98 (2008)
37 - Nonuniqueness of inverted core-mantle boundary flows and deviations from tangential geostrophy
M. A. Pais, O. Oliveira, F. Nogueira
J. Geophys. Res. 109, B08105-1-B08105-20 (2004)
38 - Pattern search methods for user-provided points: application to molecular geometry problems
P. Alberto, F. Nogueira, H. Rocha, and Luís N. Vicente
SIAM Journal on Optimization 14, 1216-1236 (2004)
39 - A plane-wave pseudopotential description of charged clusters
F. Nogueira, J. L. Martins, and C. Fiolhais
The European Physics Journal D (Atoms, Molecules and Cluster Physics) 9, 229-233 (2000)
40 - Structural phase transitions in Na, Mg and Al crystals: dominant role of the valence in local pseudopotential theory
J. P. Perdew, F. Nogueira, and C. Fiolhais
Journal of Molecular Structure (Theochem) 501-502, 261-269 (2000)
41 - Trends in the properties and structures of the simple metals from a universal local pseudopotential,
F. Nogueira, C. Fiolhais, and J. P. Perdew
Physical Review B 59, 2570-2578 (1999)
42 - Charged metal clusters: atomistic versus continuous background continuous description
F. Nogueira, A. Vieira, M. Brajczewska, and C. Fiolhais
Condensed Matter Theories, vol. XIII, J. da Providência and F. B. Malik (eds.), Nova Science, New York, 333-342 (1998)
43 - A comment on "EPR and the Copenhagen interpretation"
J. M. Domingos, F. Nogueira, M. H. Caldeira, Fernando S. dos Aidos
European Journal of Physics 19, 197 (1998)
44 - Tests of a density-based pseudopotential for sixteen simple metals
L. Pollack, J. P. Perdew, J. He, M.A.L. Marques, F. Nogueira, and C. Fiolhais
Phys. Rev. B 55, 15544-15551 (1997)
45 - The evanescent core pseudopotential: applications to surfaces and clusters
38. C. Fiolhais, F. Nogueira, and C. Henriques
Progress in Surface Science 53, 305-314 (1996)
46 - Evanescent core pseudopotential: applications to surfaces and
clusters
C. Fiolhais, F. Nogueira, and C. Henriques
Progress in Surface Science 53, 315-322 (1996)
47 - Transferability of a local pseudopotential based on solid-state electron density
F. Nogueira, C. Fiolhais, Jingson He, J. P. Perdew, and A. Rubio
Journal of Physics: Condensed Matter 8, 287-302 (1996)
48 - Locality, relativity and Bell's inequalities
F. Nogueira, M. H. Caldeira, and J. M. Domingos
Physica Scripta 53, 18-22 (1996)
49 - EPR: Copenhagen interpretation has got what it takes
J. M. Domingos, F. Nogueira, M. H. Caldeira, and F. D. dos Aidos
European Journal of Physics 17, 125-130 (1996)
50 - Expectation values and non-commuting operators
F. Nogueira, F. D. dos Aidos, M. H. Caldeira and J. M. Domingos
European Journal of Physics 13, 284-285 (1992)
Portuguese Journals
51 - Quarenta anos de Olimpíadas de Física
F. Nogueira
Gazeta de Física 47(2), 34 (2024)
52 - Condutores em bicamada; diversidade de estruturas e propriedades
I.C. Santos, V. Gama: S. Rabaça, L.F. Vieiros, F. Nogueira, J.A. Paixão, M. Almeida
Técnica, 28-30 (2021)
53 - Olimpíadas de Física
Fernando Nogueira
Gazeta de Física 41, 44-51 (2019)
Proceedings
International Conferences
54 - Recent Memory and Performance Improvements in Octopus Code
J. Alberdi-Rodriguez, M.J.T. Oliveira, P. García-Risueño, F. Nogueira, J. Muguerza, A. Arruabarrena, and A. Rubio
Computational Science and Its Applications - ICCSA 2014, B. Murgante, S. Misra, A.M.A.C. Rocha, C. Torre, J.G. Rocha, M.I. Falcão, D. Taniar, B.O. Apduhan, O. Gervasi (Eds.), 607-622 (2014)
55 - Métodos de procura em padrão aplicados a problemas de optimização de geometria molecular
P. Alberto, F. Nogueira, H. Rocha
Métodos Numéricos en Ingenería 2005
José Aparício et. al. (Eds.), SEMNI, Barcelona, ISBN 84-95999-74-9, 431 (2005)
56 - Pattern search methods for user-provided points
P. Alberto, F. Nogueira, H. Rocha and L. N. Vicente
Lecture Notes in Computer Science - Proceedings of the 2001 International Conference on Computational Science, San Francisco, USA, May 2001 2074, 95-98 (2001)
57 - Charged metal clusters: atomistic versus continuous background descriptions
F. Nogueira, A. Vieira, M. Brajczewska, and C. Fiolhais
Condensed Matter Theories, vol XIII, J. da Providência and F. B. Malik (ed.), Nova Science, New York, 333-342 (1998)
Communications
Invited
58 - Time-dependent density-functional theory: a brief overview and selected applications in physics, chemistry, and biology
Fernando Nogueira
Department of Physics, Chemistry and Biology, University of Linkoping, Sweden (2012)
59 - Colour tuning and efficiency improvements in firefly bioluminescence
Fernando Nogueira
11th Iberian Joint Meeting on Atomic and Molecular Physics, 19-22 June, Coimbra, Portugal (2011)
60 - Como prever algumas propriedades de nano-estruturas
Fernando Nogueira
Physics Department of the University of Coimbra, Portugal (October 12, 2005) (2005)
61 - Predicting some properties of nanostructures
Fernando Nogueira
ICPS 2005, Coimbra, Portugal (August 12-17, 2005) (2005)
Oral
62 - Recursos computacionais para o ensino de Física da Matéria Condensada
José António Paixão, Fernando Nogueira
5ª Conferência de Física de Países de Língua Portuguesa (2024)
63 - Atividades experimentais com supercondensadores
José António Paixão, Fernando Nogueira
5ª Conferência de Física de Países de Língua Portuguesa (2024)
64 - Formação avançada de professores do ensino secundário para preparação
de concorrentes às Olimpíadas Internacionais de Física
Fernando Nogueira, Horácio Fernandes, João M. S. Gil, José António Paixão, Manuel Fiolhais
2ª Conferência de Física da CPLP, Rio de Janeiro, Brasil, 10-12 Setembro (2012)
65 - Nonlinear optical properties of polychlorotriphenylmethyl radicals: a computational study
Cláudia Cardoso, Bruce Forbes Milne, Fernando Nogueira
March meeting of the American Physical Society, Dallas TX, USA, March 21-25 (2011)
66 - Fragment Molecular Orbital Studies of Luciferase from the Japanese Firefly Luciola cruciata (Flash presentation)
Milne B.F., Marques M.A.L. and Nogueira F.
Computational Nanoscience (MC9) Symposium, 42nd IUPAC Congress, Glasgow, Scotland (2009)
67 - Evidence of structure dependence of hyperpolarisability in octopolar molecules
C. Cardoso, P. E. Abreu, F. Nogueira
March Meeting (2008)
68 - Evidence of structure dependence of hyperpolarizability in octupolar molecules
Cláudia Cardoso, Paulo Abreu, Fernando Nogueira
2008 APS March Meeting, March 1014, New Orleans, USA (2008)
69 - Fully ab-initio study of the optical response of charged rare gas clusters
Fernando Nogueira, Micael Oliveira, Miguel Marques
2008 APS March Meeting, New Orleans, USA, March 1014 (2008)
70 - Crystal and nonlinear optical properties of triphenylguanidine: theory and experiments
C. Cardoso, P. Silva, F. Nogueira, J. A. Paixão
2007 APS March Meeting, March 5-9, Denver, USA (2007)
71 - Optical and magnetic excitations in small transition-metal clusters using TDDFT
Micael Oliveira, Fernando Nogueira, Angel Rubio
2007 APS March Meeting, Denver, USA, March 5-9 (2007)
72 - Estudo Estrutural do Formato de Trifenilguanidina por Difração de Raios-X
Pedro S. Pereira Silva and Cláudia Cardoso and José A. Paixão and Manuela Ramos Silva and Ana M. Matos Beja and Fernando Nogueira
Física 2006 - 15ª Conferência Nacional de Física, Aveiro, Portugal, 4 a 7 de Setembro (2006)
Poster
73 - Numeric local pseudopotentials through evolutionary optimisation
Fernando Nogueira, Tiago Cerqueira
CMD31-General Conference of the Condensed Matter Division of the European Physical Society (2024)
74 - High-throughput search of B-C-X superconductors
Pedro Borlido, Tiago F.T. Cerqueira, Fernando Nogueira
CMD31-General Conference of the Condensed Matter Division of the European Physical Society (2024)
75 - Ab-initio studies of Bi2Se3, Bi2Te3, and Bi2Se3-xTex
Ana Fontes, Fernando Nogueira, Pedro Borlido
Física2022, 23ª Conferência Nacional de Física, 7-10/9 (2022)
76 - Polytypism in nanostructure AgBiSe2
J.N.Q. Oliveira, J. Batista, A. Fontes, Tiago F.T. Cerqueira, F. Nogueira, J.A. Paixão
2º Encontro Nacional de Cristalografia Lisboa, 15-16/7 (2022)
77 - First-principles calculation of superconducting transition temperature of Al-Li-Pd ternary materials
Josué Vermelo, Fernando Nogueira, Tiago F.T. Cerqueira
Física2022, 23ª Conferência Nacional de Física, 7-10/9 (2022)
78 - Graph theory approach to wildfire supression
João Aveiro, Daniel Neves, Paulo Silva, Orlando Oliveira, Fernando Nogueira, Jaime Oliveira da Silva
Física2022, 23ª Conferência Nacional de Física, 7-10/9 (2022)
79 - Phase diagrams of high-pressure ternary systems
João N.Q. Oliveira, Fernando Nogueira, Tiago F.T. Cerqueira
Física2022-23ª Conferência Nacional de Física, 7-10/9 (2022)
80 - Automated search for new I-V-VI(2) thermoelectric materials
Tiago F.T. Cerqueira, Fernando Nogueira
Towards understanding and modelling intense electronic excitation / CA17126,
Working Group Meeting + MC Meeting + Core Group Meeting,
17 & 18 February 2020,
Warsaw, Poland (2020)
81 - The Quinoline-Quinolone Tautomerism in Cyclisation Reactions of Aryl-enamines. Relevance for Quinolone-based Anti-malarials Design
E.M. Brás, P. Horta, M.S.C. Henriques, F. Murtinheira, F. Nogueira, P.M. O’Neill, J.A. Paixão, Rui Fausto, M.L.S. Cristiano
12º Encontro Nacional de Química Orgânica e 5º Encontro de Química Terapêutica, Coimbra, 17-19/01 (2018)
82 - Marine natural products: a new source of novel chromophores for nonlinear optics
Bruce F. Milne, Cláudia Cardoso, Marcel Jaspars, Fernando Nogueira
Gordon Research Conference - Marine Natural Products, Ventura, CA, USA (2012)
83 - Optical absorption of metal-encapsulating Si cages from TDDFT
M.J.T. Oliveira, J. R. F. Sousa, P. V. C. Medeiros, G. K. Gueorguiev, F. Nogueira
ETSF Workshop 2012 Coimbra, Portugal, October 2-5 (2012)
84 - Gas phase spectroscopy of the firefly luciferin anion: comparison of experiment with TDDFT predictions
Bruce F. Milne, Kristian Støchkel, Steen Brønsted Nielsen and Fernando Nogueira
Faraday Discussions 150 "Frontiers in Spectroscopy", Basel, Switzerland (2011)
85 - Electronic Properties of Doped Silicon Nanocrystals,
E. L. Silva, J. Coutinho, F. Nogueira
Time-Dependent Density-Functional Theory: Prospects and Applications 4th, Centro de Ciencias de Benasque Pedro Pascual, Benasque, Spain (2010)
86 - Computational study of high intrinsic hyperpolarizability molecules
C. Cardoso, P. E. Abreu, F. Nogueira
Gordon research Conferences, Time-Dependent Density-Functional Theory (2009)
87 - Computational study of high intrinsic hyperpolarizability molecules
C. Cardoso, P. E. Abreu, F. Nogueira
9º Encontro Nacional de Química-Física, Aveiro (2009)
88 - Bio-HeteroJunction Effect Origin and Efficiency Improvement of Firefly Chromophores
Duan J. Cai, Miguel A. L. Marques , Bruce F. Milne, Fernando Nogueira
Gordon Research Conference on Time-Dependent Density Functional Theory, Colby-Sawyer College, New London, NH, USA (2009)
89 - Photoabsorption Spectra of Small Cationic Xenon Clusters from TDDFT
M.J.T. Oliveira, F. Nogueira, M.A.L. Marques, Angel Rubio
6th NQ-ETSF Young Researchers Meeting,
Berlin, Germany, June 2-6 (2009)
90 - Fragment Molecular Orbital Studies of Luciferase from the Japanese Firefly Luciola cruciata
Milne B.F., Marques M.A.L. and Nogueira F.
Computational Nanoscience (MC9) Symposium, 42nd IUPAC Congress, Glasgow, Scotland (2009)
91 - Fragment Molecular Orbital Studies of Luciferase from the Japanese Firefly Luciola cruciata
Milne B.F., Marques M.A.L. and Nogueira F.
Gordon Research Conference on Time-Dependent Density Functional Theory, Colby-Sawyer College, New London, NH, USA (2009)
92 - Fragment Molecular Orbital Studies of Luciferase from the Japanese Firefly Luciola cruciata
Milne B.F., Marques M.A.L., Nogueira F.
14th ETSF Workshop on Electronic Excitations, Evora, Portugal (2009)
93 - Capillary growth induced by tumors
Susana Silva, Rui D. M. Travasso, and Fernando Nogueira,
Apresentacao Intercalar dos Projectos de Engenharia Biomedica, Coimbra, Portugal 3rd - 5th June (2009)
94 - Capillary growth induced by tumors
Susana Silva, Rui D. M. Travasso, and Fernando Nogueira,
Apresentacao Intercalar dos Projectos de Engenharia Biomedica, Coimbra, Portugal, 18th-20th Feb (2009)
95 - Crystal structure, experimental and ab initio studies of the spectroscopic properties of N,N',N"-triphenylguanidinium chloride
P.S. Pereira Silva, C. Cardoso, J.A. Paixão, M. Ramos Silva, A. Matos Beja, F. Nogueira
8º Encontro Nacional de Química Física da Sociedade Portuguesa de Química (2007)
96 - Cálculos ab initio para a molecular octopular trifenilguanidina
C. Cardoso, P. S. Pereira Silva, F. Nogueira, J. A. Paixão
15ª Conferência Nacional de Física, 4 a 7 de Setembro, Aveiro, Portugal (2006)
97 - Ab initio calculations for two forms of triphenylguanidine
Cláudia Cardoso, Micael Oliveira, Fernando Nogueira, José António Paixão
2nd International workshop Time-dependent Density-Functional Theory: Prospects and Applications, 6 a 10 de Setembro, Benasque, Espanha (2006)
98 - X-Ray Diffraction Studies of Octupolar Molecules
P.S. Pereira Silva, J.A. Paixão, M. Ramos Silva, A. Matos Beja, C. Cardoso, F. Nogueira
10th International Symposium on Radiation Physics, 17 a de 22 Setembro, Coimbra, Portugal (2006)
99 - Exploring the non-unicity of inverted CMB flows
A. Pais, O. Oliveira, F. Nogueira
Geophysical Research Abstracts 5, 11694 (2003)
100 - Different methods to compute flows at the core-mantle boundary
from geomagnetic data
F. Nogueira, O. Oliveira, M. A. Pais, G. Hulot, J.-L. Le Mouël
26th General Assembly of European Geophysical Society (2001)
Thesis
PhD thesis
101 - Description of physical properties of solids and clusters with pseudopotentials
Fernando Nogueira
University of Coimbra (1999)
MSc thesis
102 - Relatório de Estágio de Mestrado em Ensino de Física e de Química no 3º ciclo do Ensino Básico e no Ensino Secundário
Mário Sérgio de Melo Nogueira Figueiredo Gomes
(2019)
103 - As desigualdades de Bell e o conflito entre a localidade e a Mecânica Quântica
F. Nogueira
University of Coimbra (1993)
Other
104 - Graph-Based Strategies for Optimizing Wildfire Supression
J. Aveiro, D. Neves, Paulo J. Silva, O. Oliveira, F. Nogueira, Jaime Oliveira da Silva,
(2023)
Thesis supervised
- Relativistic effects in the optical response of low-dimensional structures: new developments and applications within a time-dependent density functional theory framework
Micael Oliveira
PhD thesis, University of Coimbra (2008) - First-principles calculation of superconducting transition temperature of AlxLiyPdz ternary materials
Josué António Vermelo
MSc thesis, MSc. Thesis in Physics (2022) - Phase diagrams of high-pressure ternary systems
João Miguel Nunes Quaresma de Oliveira
MSc thesis, MSc Thesis in Physics (2022) - First principle calculations for Topological Insulators: the (Sb,Bi)(2(Se,Te)3 compounds
El-abbas Endaisha
MSc thesis, (2017) - Systematic benchmarking of exchange and correlation functionals for the G2 dataset
João Carlos Correia Abreu
MSc thesis, University of Coimbra (2015) - Optical and Magnetical Properties of Endohedral Silicon Cages
Mário Rui Gonçalves Marques
MSc thesis, University of Coimbra (2015) - Optical and magnetic properties of transition metal clusters
Tiago João Ferreira Gonçalves
MSc thesis, University of Coimbra (2015) - Energias de ionização atómicas com funcionais híbridos
Pedro Miguel Castro Borlido
MSc thesis, University of Coimbra (2014) - Influence of the Exchange and Correlation Functional in the Ionization Potentials of Atoms
Tiago F.T. Cerqueira
MSc thesis, University of Coimbra (2012) - Electronic Properties of Doped Silicon Nanocrystals
E. L. Silva
MSc thesis, University of Coimbra (2010) - Phase-Field Models for Tumor Growth in the Avascular Phase
Susana P. L. Dias da Silva
MSc thesis, Universidade de Coimbra (2009)
Knowledge Transfer
Projects
- 2D Molecular Metals and Superconductors; Coherence and anisotropy in bilayer systems
- Ab-initio search for practical superconducting materials
- Delfos e Quark!-escolas de Matemática e de Física para jovens
- First principles and x-ray studies of the charge density and optical properties of octupolar molecules
- Novel topological insulator and superconducting materials
- Optimization in Physics
- PRACE
- PRACE-1IP
- PRACE-2IP
- Probing structural dynamics of artificial molecular machinery using microwave spectroscopy
- Quark!-Ecola de Física para Jovens da UC
Management
Outreach
- Quark!-escola de Física para Jovens 2016-2017 (20/Jan/2017)
- Quark!-escola de Física para Jovens Sessão 1 (2016) (29/Jan/2016)
- Quark!-escola de Física para Jovens 2015-2016 (29/Jan/2016)
- 10^-9 m : parece pequeno... mas não é! (25/Nov/2015)
- Experimental Physics without Laboratory (24/Feb/2015)
- Experimental Physics without Laboratory (26/Nov/2014)
- Experimental Physics without Laboratory (20/Oct/2014)
- Experimental Physics without Laboratory (31/Jan/2012)
- Advanced Course in Physics (01/Jan/2012)
- Advanced Course in Physics (01/Oct/2011)