All Stories

  1. Effect of edge passivation on the electronic and transport properties of graphene nanogaps

    Article • January 2022, American Institute of Physics

    Victor Garcia-Suarez

  2. Development of spontaneous magnetism and half-metallicity in monolayer MoS 2

    Article • Journal of Magnetism and Magnetic Materials, December 2017, Elsevier

    Victor Garcia-Suarez

  3. Thermoelectricity in vertical graphene-C60-graphene architectures

    Article • Scientific Reports, September 2017, Springer Science + Business Media

    Victor Garcia-Suarez, Prof Hatef Sadeghi

  4. Synthesis and Single-Molecule Conductance Study of Redox-Active Ruthenium Complexes with Pyridyl and Dihydrobenzo[b ]thiophene Anchoring Groups

    Article • Chemistry - A European Journal, July 2016, Wiley

    Dr Veerabhadrarao Kaliginedi, Victor Garcia-Suarez

  5. On determining defects identity in carbon nanotubes using charge probes

    Article • Applied Surface Science, June 2016, Elsevier

    Victor Garcia-Suarez

  6. Distortion induced magnetic phase transition in cubic BaFeO 3

    Article • Journal of Magnetism and Magnetic Materials, March 2016, Elsevier

    Victor Garcia-Suarez

  7. Low variability of single-molecule conductance assisted by bulky metal–molecule contacts

    Article • RSC Advances, January 2016, Royal Society of Chemistry

    Victor Garcia-Suarez

  8. Solvent Dependence of the Single Molecule Conductance of Oligoyne-Based Molecular Wires

    Article • The Journal of Physical Chemistry C, December 2015, American Chemical Society (ACS)

    Victor Garcia-Suarez

  9. Systematic pseudopotentials from reference eigenvalue sets for DFT calculations: Pseudopotential files

    Article • Data in Brief, June 2015, Elsevier

    Victor Garcia-Suarez

  10. Systematic pseudopotentials from reference eigenvalue sets for DFT calculations

    Article • Computational Materials Science, February 2015, Elsevier

    Victor Garcia-Suarez

  11. Stability and properties of high-buckled two-dimensional tin and lead

    Article • Physical Review B, December 2014, American Physical Society (APS)

    Victor Garcia-Suarez

  12. GOLLUM: a next-generation simulation tool for electron, thermal and spin transport

    Article • New Journal of Physics, September 2014, Institute of Physics Publishing

    Victor Garcia-Suarez, Prof Hatef Sadeghi

  13. Graphene Sculpturene Nanopores for DNA Nucleobase Sensing

    Article • The Journal of Physical Chemistry, June 2014, American Chemical Society (ACS)

    Victor Garcia-Suarez, Prof Hatef Sadeghi

  14. Redox control of thermopower and figure of merit in phase-coherent molecular wires

    Article • Nanotechnology, April 2014, Institute of Physics Publishing

    Victor Garcia-Suarez

  15. Impact of Fano and Breit-Wigner resonances in the thermoelectric properties of nanoscale junctions

    Article • Physical Review B, December 2013, American Physical Society (APS)

    Victor Garcia-Suarez

  16. Symmetry-induced quantum interference effects in metalloporphyrin wires

    Article • Journal of Physics Condensed Matter, July 2013, Institute of Physics Publishing

    Victor Garcia-Suarez

  17. Universality in the low-voltage transport response of molecular wires physisorbed onto graphene electrodes

    Article • Physical Review B, June 2013, American Physical Society (APS)

    Victor Garcia-Suarez

  18. Stabilizing intrinsic defects in SnO2

    Article • Physical Review B, May 2013, American Physical Society (APS)

    Victor Garcia-Suarez

  19. Intrinsic magnetism in nanosheets of SnO2: A first-principles study

    Article • Journal of Magnetism and Magnetic Materials, February 2013, Elsevier

    Victor Garcia-Suarez

  20. Simplifying the conductance profiles of molecular junctions: the use of the trimethylsilylethynyl moiety as a molecule–gold contact

    Article • Dalton Transactions, January 2013, Royal Society of Chemistry

    Victor Garcia-Suarez

  21. Nonequilibrium transport response from equilibrium transport theory

    Article • Physical Review B, September 2012, American Physical Society (APS)

    Victor Garcia-Suarez

  22. Charge and spin transport properties of Mo2X2(X= Fe,Co,Ni) molecular contacts

    Article • Physical Review B, June 2012, American Physical Society (APS)

    Victor Garcia-Suarez

  23. Impact of edge shape on the functionalities of graphene-based single-molecule electronics devices

    Article • Physical Review B, May 2012, American Physical Society (APS)

    Victor Garcia-Suarez

  24. Correlations between Molecular Structure and Single-Junction Conductance: A Case Study with Oligo(phenylene-ethynylene)-Type Wires

    Article • Journal of the American Chemical Society, March 2012, American Chemical Society (ACS)

    Dr Veerabhadrarao Kaliginedi, Victor Garcia-Suarez

  25. Long-range electron tunnelling in oligo-porphyrin molecular wires

    Article • Nature Physics, July 2011, Springer Science + Business Media

    Victor Garcia-Suarez

  26. Structure and electronic properties of molybdenum monatomic wires encapsulated in carbon nanotubes

    Article • Journal of Physics Condensed Matter, June 2011, Institute of Physics Publishing

    Victor Garcia-Suarez

  27. First-principles scheme for spectral adjustment in nanoscale transport

    Article • New Journal of Physics, May 2011, Institute of Physics Publishing

    Victor Garcia-Suarez

  28. Quantum interference in single molecule electronic systems

    Article • Physical Review B, February 2011, American Physical Society (APS)

    Victor Garcia-Suarez

  29. Effects of bonding type and interface geometry on coherent transport through the single-molecule magnetMn12

    Article • Physical Review B, March 2010, American Physical Society (APS)

    Victor Garcia-Suarez

  30. Current rectification in molecular junctions produced by local potential fields

    Article • Physical Review B, February 2010, American Physical Society (APS)

    Victor Garcia-Suarez

  31. Impact of dimerization and stretching on the transport properties of molybdenum atomic wires

    Article • Nanotechnology, February 2010, Institute of Physics Publishing

    Victor Garcia-Suarez

  32. Surface-induced magnetism in C-doped SnO2

    Article • Applied Physics Letters, February 2010, American Institute of Physics

    Victor Garcia-Suarez

  33. Oligoyne Single Molecule Wires

    Article • Journal of the American Chemical Society, November 2009, American Chemical Society (ACS)

    Victor Garcia-Suarez

  34. Tuning the conductance of molecular junctions: Transparent versus tunneling regimes

    Article • Physical Review B, August 2009, American Physical Society (APS)

    Victor Garcia-Suarez

  35. Effects of antidots on the transport properties of graphene nanoribbons

    Article • Physical Review B, August 2009, American Physical Society (APS)

    Victor Garcia-Suarez

  36. First-Principles Study of Electron Transport through the Single-Molecule MagnetMn12

    Article • Physical Review Letters, June 2009, American Physical Society (APS)

    Victor Garcia-Suarez

  37. Spin-filtering effect in the transport through a single-molecule magnet Mn12 bridged between metallic electrodes

    Article • Journal of Applied Physics, April 2009, American Institute of Physics

    Victor Garcia-Suarez

  38. Adverse effects of asymmetric contacts on single molecule conductances of HS(CH2)nCOOH in nanoelectrical junctions

    Article • Nanotechnology, March 2009, Institute of Physics Publishing

    Victor Garcia-Suarez

  39. Anisotropic magnetoresistance in atomic chains of iridium and platinum from first principles

    Article • Physical Review B, February 2009, American Physical Society (APS)

    Victor Garcia-Suarez

  40. Giant thermopower and figure of merit in single-molecule devices

    Article • Physical Review B, January 2009, American Physical Society (APS)

    Victor Garcia-Suarez

  41. From microelectronics to molecular spintronics: an explorer's travelling guide

    Article • Journal of Materials Chemistry, January 2009, Royal Society of Chemistry

    Victor Garcia-Suarez

  42. Tailoring the Fermi level of the leads in molecular-electronic devices

    Article • Physical Review B, December 2008, American Physical Society (APS)

    Victor Garcia-Suarez

  43. Vacancy-induced magnetism inSnO2: A density functional study

    Article • Physical Review B, November 2008, American Physical Society (APS)

    Victor Garcia-Suarez

  44. Non-trivial length dependence of the conductance and negative differential resistance in atomic molecular wires

    Article • Nanotechnology, October 2008, Institute of Physics Publishing

    Victor Garcia-Suarez

  45. The effect of stretching thiyl– and ethynyl–Au molecular junctions

    Article • Journal of Physics Condensed Matter, December 2007, Institute of Physics Publishing

    Professor Michael B Cortie, Victor Garcia-Suarez

  46. Conformation dependence of molecular conductance: chemistry versus geometry

    Article • Journal of Physics Condensed Matter, December 2007, Institute of Physics Publishing

    Victor Garcia-Suarez

  47. Functionalized 8 nm Long Aryleneethynylene Molecular Wire with Alkyne Termini

    Article • European Journal of Organic Chemistry, November 2007, Wiley

    Dr Xianshun Zeng, Victor Garcia-Suarez

  48. Study of the transport properties of a molecular junction as a function of the distance between the leads

    Article • physica status solidi (b), July 2007, Wiley

    Victor Garcia-Suarez

  49. Electronic properties of alkali- and alkaline-earth-intercalated silicon nanowires

    Article • Physical Review B, February 2007, American Physical Society (APS)

    Victor Garcia-Suarez

  50. Predictions for the formation of atomic chains in mechanically controllable break-junction experiments

    Article • Physical Review B, February 2007, American Physical Society (APS)

    Victor Garcia-Suarez

  51. Characteristic jump in the electrical properties of aPd∕AlN∕Si-based device on exposure to hydrogen

    Article • Physical Review B, February 2007, American Physical Society (APS)

    Victor Garcia-Suarez

  52. Geometry dependence of the conductance oscillations of monovalent atomic chains

    Article • physica status solidi (b), February 2007, Wiley

    Victor Garcia-Suarez

  53. Giant magnetoresistance of nickel-contacted carbon nanotubes

    Article • Journal of Physics Condensed Matter, January 2007, Institute of Physics Publishing

    Victor Garcia-Suarez

  54. Strongly correlated electron physics in nanotube-encapsulated metallocene chains

    Article • Physical Review B, November 2006, American Physical Society (APS)

    Victor Garcia-Suarez

  55. Tuning the Electrical Conductivity of Nanotube-Encapsulated Metallocene Wires

    Article • Physical Review Letters, March 2006, American Physical Society (APS)

    Victor Garcia-Suarez

  56. Spin and molecular electronics in atomically generated orbital landscapes

    Article • Physical Review B, February 2006, American Physical Society (APS)

    Victor Garcia-Suarez

  57. Nonuniversal behavior of the parity effect in monovalent atomic wires

    Article • Physical Review B, January 2006, American Physical Society (APS)

    Victor Garcia-Suarez

  58. Electronic Properties of Metallocene Wires

    Article • January 2006, Institute of Electrical & Electronics Engineers (IEEE)

    Victor Garcia-Suarez

  59. Conductance Oscillations in Zigzag Platinum Chains

    Article • Physical Review Letters, December 2005, American Physical Society (APS)

    Victor Garcia-Suarez

  60. Single-channel conductance ofH2molecules attached to platinum or palladium electrodes

    Article • Physical Review B, July 2005, American Physical Society (APS)

    Victor Garcia-Suarez

  61. Relationship between strain and the surface electronic structure of Cu(111) films on Ru(0001): Theory and experiment

    Article • Physical Review B, March 2005, American Physical Society (APS)

    Victor Garcia-Suarez

  62. Towards molecular spintronics

    Article • Nature Materials, March 2005, Springer Science + Business Media

    Victor Garcia-Suarez

  63. First principles simulations of the magnetic and structural properties of Iron

    Article • The European Physical Journal B, August 2004, Springer Science + Business Media

    Victor Garcia-Suarez

  64. Optimized basis sets for the collinear and non-collinear phases of iron

    Article • Journal of Physics Condensed Matter, July 2004, Institute of Physics Publishing

    Victor Garcia-Suarez

  65. Tailoring surface electronic states via strain to control adsorption: O/Cu/Ru(0001)

    Article • Surface Science, February 2004, Elsevier

    Victor Garcia-Suarez