Prof. Dr. Miguel Marques


E-Mail: miguel.marques@rub.de

Miguel Marques too studied physics, namely at the University of Coimbra in his native Portugal. He obtained his doctorate in 2000, likewise in physics, at the University of Würzburg in the field of density functional theory of superconductors. Marques then held several postdoctoral positions in Spain, Germany and France; he habilitated in Lyon in 2009. Most recently, he was a professor at Martin Luther University Halle-Wittenberg.

https://www.icams.de/institute/departments-groups/artificial-intelligence/

Publications

  • 2006
2006
  • article
article2006Daniele VarsanoRosa Di FeliceMiguel A. L. MarquesAngel Rubio

A TDDFT study of the excited states of DNA bases and their assemblies

Daniele Varsano, Rosa Di Felice, Miguel A. L. Marques, Angel Rubio:
Journal of Physical Chemistry B (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33646260931&doi=10.1021%2fjp056120g&partnerID=40&md5=4083faa76a1bae868d4ba100d2de44b3https://dx.doi.org/10.1021/jp056120g
2006
  • article
article2006A. SannaC. FranchiniA. FlorisG. ProfetaN.N. LathiotakisM. LüdersM.A.L. MarquesE.K.U. GrossA. ContinenzaS. Massidda

Ab initio prediction of pressure-induced superconductivity in potassium

A. Sanna, C. Franchini, A. Floris, G. Profeta, N.N. Lathiotakis, M. Lüders, M.A.L. Marques, E.K.U. Gross, A. Continenza, S. Massidda:
Physical Review B - Condensed Matter and Materials Physics (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33645815904&doi=10.1103%2fPhysRevB.73.144512&partnerID=40&md5=a5cd10be8564b3510fdb3d00f9fafa8dhttps://dx.doi.org/10.1103/PhysRevB.73.144512
2006
  • article
article2006A. ContinenzaG. ProfetaA. FlorisC. FranchiniS. MassiddaN.N. LathiotakisM.A.L. MarquesM. LüdersE.K.U. Gross

Ab-initio computation of superconducting properties of elemental superconductors and MgB2

A. Continenza, G. Profeta, A. Floris, C. Franchini, S. Massidda, N.N. Lathiotakis, M.A.L. Marques, M. Lüders, E.K.U. Gross:
Journal of Superconductivity (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33744523030&doi=10.1007%2fs10948-005-0052-8&partnerID=40&md5=44d45d1d1e09313f29609dbdb791fd07https://dx.doi.org/10.1007/s10948-005-0052-8
2006
  • article
article2006X. LopezM.A.L. Marques

Biochromophores

X. Lopez, M.A.L. Marques:
Lecture Notes in Physics (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33749146539&doi=10.1007%2f3-540-35426-3_22&partnerID=40&md5=ceb1d93600aaf573879f3dd913b17a3ehttps://dx.doi.org/10.1007/3-540-35426-3_22
2006
  • article
article2006Miguel A. L. MarquesMayeul D'AvezacFrancesco Mauri

Magnetic response and NMR spectra of carbon nanotubes from ab initio calculations

Miguel A. L. Marques, Mayeul D'Avezac, Francesco Mauri:
Physical Review B - Condensed Matter and Materials Physics (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33645383282&doi=10.1103%2fPhysRevB.73.125433&partnerID=40&md5=4b536c6d7781094f75ee0e3aae786378https://dx.doi.org/10.1103/PhysRevB.73.125433
2006
  • article
article2006Alberto CastroHeiko AppelMicael OliveiraCarlo A. RozziXavier AndradeFlorian LorenzenM.A.L. MarquesE.K.U. GrossAngel Rubio

Octopus: A tool for the application of time-dependent density functional theory

Alberto Castro, Heiko Appel, Micael Oliveira, Carlo A. Rozzi, Xavier Andrade, Florian Lorenzen, M.A.L. Marques, E.K.U. Gross, Angel Rubio:
Physica Status Solidi (B) Basic Research (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33747601440&doi=10.1002%2fpssb.200642067&partnerID=40&md5=2d8ddb4b1f7437dabb9d28c44d10daa5https://dx.doi.org/10.1002/pssb.200642067
2006
  • article
article2006A. CastroM.A.L. Marques

Propagators for the time-dependent Kohn-Sham equations

A. Castro, M.A.L. Marques:
Lecture Notes in Physics (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33749129177&doi=10.1007%2f3-540-35426-3_12&partnerID=40&md5=8dba539a41d1342e3244c1b5b87e9309https://dx.doi.org/10.1007/3-540-35426-3_12
2006
  • article
article2006G. ProfetaC. FranchiniN.N. LathiotakisA. FlorisA. SannaM.A.L. MarquesM. LüdersS. MassiddaE.K.U. GrossA. Continenza

Superconductivity in lithium, potassium, and aluminum under extreme pressure: A first-principles study

G. Profeta, C. Franchini, N.N. Lathiotakis, A. Floris, A. Sanna, M.A.L. Marques, M. Lüders, S. Massidda, E.K.U. Gross, A. Continenza:
Physical Review Letters (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33144485117&doi=10.1103%2fPhysRevLett.96.047003&partnerID=40&md5=627dea56355c1717804f83e7b9904530https://dx.doi.org/10.1103/PhysRevLett.96.047003
2006
  • article
article2006M.A.L. MarquesA. Rubio

Time versus frequency space techniques

M.A.L. Marques, A. Rubio:
Lecture Notes in Physics (2006)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33749158035&doi=10.1007%2f3-540-35426-3_15&partnerID=40&md5=0c0ef6aeb21a96823fbad0efda1068d3https://dx.doi.org/10.1007/3-540-35426-3_15
  • 2005
2005
  • article
article2005R. CaudilloH.E. TroianiM. Miki-YoshidaM.A.L. MarquesA. RubioM.J. Yacaman

A viable way to tailor carbon nanomaterials by irradiation-induced transformations

R. Caudillo, H.E. Troiani, M. Miki-Yoshida, M.A.L. Marques, A. Rubio, M.J. Yacaman:
Radiation Physics and Chemistry (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-21344455939&doi=10.1016%2fj.radphyschem.2004.10.003&partnerID=40&md5=0bc41731d8cee8667638bbf76de4110chttps://dx.doi.org/10.1016/j.radphyschem.2004.10.003
2005
  • article
article2005M. LüdersM.A.L. MarquesN.N. LathiotakisA. FlorisG. ProfetaL. FastA. ContinenzaS. MassiddaE.K.U. Gross

Ab initio theory of superconductivity. I. Density functional formalism and approximate functionals

M. Lüders, M.A.L. Marques, N.N. Lathiotakis, A. Floris, G. Profeta, L. Fast, A. Continenza, S. Massidda, E.K.U. Gross:
Physical Review B - Condensed Matter and Materials Physics (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33644949914&doi=10.1103%2fPhysRevB.72.024545&partnerID=40&md5=9f4b95be5d112420fd73f6dedd24190ahttps://dx.doi.org/10.1103/PhysRevB.72.024545
2005
  • article
article2005M.A.L. MarquesM. LüdersN.N. LathiotakisG. ProfetaA. FlorisL. FastA. ContinenzaE.K.U. GrossS. Massidda

Ab initio theory of superconductivity. II. Application to elemental metals

M.A.L. Marques, M. Lüders, N.N. Lathiotakis, G. Profeta, A. Floris, L. Fast, A. Continenza, E.K.U. Gross, S. Massidda:
Physical Review B - Condensed Matter and Materials Physics (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-33749159403&doi=10.1103%2fPhysRevB.72.024546&partnerID=40&md5=a293ae593622b25370b4e87313fdde21https://dx.doi.org/10.1103/PhysRevB.72.024546
2005
  • book
book2005S. KurthM.A.L. MarquesE.K.U. Gross

Density-Functional Theory

S. Kurth, M.A.L. Marques, E.K.U. Gross:
Encyclopedia of Condensed Matter Physics (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-84898631527&doi=10.1016%2fB0-12-369401-9%2f00445-9&partnerID=40&md5=c4af7a81272f93314198aa807a9b9092https://dx.doi.org/10.1016/B0-12-369401-9/00445-9
2005
  • article
article2005Xabier LópezMiguel A. L. MarquesAlberto CastroAngel Rubio

Optical absorption of the blue fluorescent protein: A first-principles study

Xabier López, Miguel A. L. Marques, Alberto Castro, Angel Rubio:
Journal of the American Chemical Society (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-24644512135&doi=10.1021%2fja050935l&partnerID=40&md5=afd4be9362a694f2a8013690889f88ebhttps://dx.doi.org/10.1021/ja050935l
2005
  • article
article2005A. FlorisG. ProfetaN.N. LathiotakisM. LüdersM.A.L. MarquesC. FranchiniE.K.U. GrossA. ContinenzaS. Massidda

Superconducting properties of MgB2 from first principles

A. Floris, G. Profeta, N.N. Lathiotakis, M. Lüders, M.A.L. Marques, C. Franchini, E.K.U. Gross, A. Continenza, S. Massidda:
Physical Review Letters (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-18144403852&doi=10.1103%2fPhysRevLett.94.037004&partnerID=40&md5=5f2eb857728d5b03da57245581a2592ahttps://dx.doi.org/10.1103/PhysRevLett.94.037004
2005
  • article
article2005Miguel A. L. MarquesSilvana Botti

The planar-to-tubular structural transition in boron clusters from optical absorption

Miguel A. L. Marques, Silvana Botti:
Journal of Chemical Physics (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-22844441135&doi=10.1063%2f1.1948386&partnerID=40&md5=7fbc4808b1f7b2a114efcbc5a093b6f0https://dx.doi.org/10.1063/1.1948386
2005
  • article
article2005T. BurnusM.A.L. MarquesE.K.U. Gross

Time-dependent electron localization function

T. Burnus, M.A.L. Marques, E.K.U. Gross:
Physical Review A - Atomic, Molecular, and Optical Physics (2005)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-18444395863&doi=10.1103%2fPhysRevA.71.010501&partnerID=40&md5=cae50b3461622bab5f61f2c404c5eb88https://dx.doi.org/10.1103/PhysRevA.71.010501
  • 2004
2004
  • article
article2004N.N. LathiotakisM.A.L. MarquesM. LüdersL. FastE.K.U. Gross

Density functional theory for superconductors

N.N. Lathiotakis, M.A.L. Marques, M. Lüders, L. Fast, E.K.U. Gross:
International Journal of Quantum Chemistry (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-4544311180&doi=10.1002%2fqua.20044&partnerID=40&md5=b85077688f9e52eab8a8323d9c18ac52https://dx.doi.org/10.1002/qua.20044
2004
  • article
article2004A. CastroM.A.L. MarquesJ.A. AlonsoG.F. BertschA. Rubio

Excited states dynamics in time-dependent density functional theory. High-field molecular dissociation and harmonic generation

A. Castro, M.A.L. Marques, J.A. Alonso, G.F. Bertsch, A. Rubio:
European Physical Journal D (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-1142266638&doi=10.1140%2fepjd%2fe2003-00306-3&partnerID=40&md5=90f3bc7b62d71a2bdf0c0a66bfaa72e5https://dx.doi.org/10.1140/epjd/e2003-00306-3
2004
  • article
article2004M.A.L. MarquesH.E. TroianiM. Miki-YoshidaM. Jose-YacamanA. Rubio

On the breaking of carbon nanotubes under tension

M.A.L. Marques, H.E. Troiani, M. Miki-Yoshida, M. Jose-Yacaman, A. Rubio:
Nano Letters (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-2642531699&doi=10.1021%2fnl049839t&partnerID=40&md5=a46b41bfb316b8ecc6cc43625b04fe34https://dx.doi.org/10.1021/nl049839t
2004
  • article
article2004Albedo CastroMiguel A.L. MarquesJulio A. AlonsoAngel Rubio

Optical properties of nanostructures from time-dependent density functional theory

Albedo Castro, Miguel A.L. Marques, Julio A. Alonso, Angel Rubio:
Journal of Computational and Theoretical Nanoscience (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-15444380744&partnerID=40&md5=4f2538eafc716105ababb7a0da395776
2004
  • article
article2004Daniele VarsanoM.A.L. MarquesAngel Rubio

Time and energy-resolved two photon photoemission of the Cu(1 0 0) and Cu(1 1 1) metal surfaces

Daniele Varsano, M.A.L. Marques, Angel Rubio:
Computational Materials Science (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-1942420828&doi=10.1016%2fj.commatsci.2004.01.017&partnerID=40&md5=d1f38920a71d4a179587f43c7c13abf7https://dx.doi.org/10.1016/j.commatsci.2004.01.017
2004
  • article
article2004M.A.L. MarquesE.K.U. Gross

Time-dependent density functional theory

M.A.L. Marques, E.K.U. Gross:
Annual Review of Physical Chemistry (2004)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-3342927029&doi=10.1146%2fannurev.physchem.55.091602.094449&partnerID=40&md5=823aeedabe468b614dd8d537c7dcfdc6https://dx.doi.org/10.1146/annurev.physchem.55.091602.094449
  • 2003
2003
  • article
article2003H.E. TroianiM. Miki-YoshidaG.A. Camacho-BragadoM.A.L. MarquesA. RubioJ.A. AscencioM. Jose-Yacaman

Direct observation of the mechanical properties of single-walled carbon nanotubes and their junctions at the atomic level

H.E. Troiani, M. Miki-Yoshida, G.A. Camacho-Bragado, M.A.L. Marques, A. Rubio, J.A. Ascencio, M. Jose-Yacaman:
Nano Letters (2003)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-0141744967&doi=10.1021%2fnl0341640&partnerID=40&md5=b759b1f1bc96593522a834ac4f3ce29ahttps://dx.doi.org/10.1021/nl0341640
2003
  • article
article2003Miguel A.L. MarquesAlberto CastroGeorge F. BertschAngel Rubio

Octopus: A first-principles tool for excited electron-ion dynamics

Miguel A.L. Marques, Alberto Castro, George F. Bertsch, Angel Rubio:
Computer Physics Communications (2003)

https://www.scopus.com/inward/record.uri?eid=2-s2.0-0037351976&doi=10.1016%2fS0010-4655%2802%2900686-0&partnerID=40&md5=e51a192037ee0bc114a73559019f2d2ehttps://dx.doi.org/10.1016/S0010-4655(02)00686-0