Lincoln Repository

Items where Division is "School of Mathematics and Physics" and Year is 2010

Group by: Creators | Keywords | Item Type | No Grouping

Ab initio calculations Ab initio simulations Adsorbed water Anion vacancy Associated Lie ring Atomic force microscopy Au(111) surface Automorphism Binomial transform Block copolymer films Block-cut-vertex tree Brownian Dynamics Calcite Calcite surface Carbonate minerals Carboxylation Cation vacancies Cell dynamics Computational methods Computer simulation Congruences Copolymerization Correlation function Cylinders (shapes) DENSITY-FUNCTIONAL THEORY; GENERALIZED GRADIENT APPROXIMATION; SCANNING-TUNNELING-MICROSCOPY; SUPRAMOLECULAR STRUCTURES; HYDROGEN; ADSORPTION; NETWORK; NANOSTRUCTURES; ORGANIZATION; MONOLAYERS Density functional theory Density functional theory calculations Electrostatics Energy position Fermi-Pasta-Ulam Film interfaces Frobenius group Gas-phase analysis Golf balls Hydrogen Bonding Hydrogen bonds Hydroxide ions Hydroxides Infinite permutation groups Inorganic surfaces Integer sequences Interface Ions Lattice parameters Low energy electron diffraction Metal surfaces Model system Modular Lie algebra Molecular dynamics Molecules Multiple sums Nanobeads Nanocapsules Nanocontainers Nanotubes Nilpotent group Noncontact atomic force microscopy Orbital graph Organic acids Oxide minerals, Scanning tunneling microscopy PTCDA; AU(111) SURFACE; METAL-SURFACES; NETWORKS; MELAMINE; GROWTH Particle radii Permutation groups Phosphonates Phosphonic acids Planar structures Plastic products Poincaré-Lindstedt method Potential energy Primitive Primitive digraph Primitive graph Protons Rutile TiO SCANNING-TUNNELING-MICROSCOPY; ORGANIC THIN-FILM; HOMOPAIRING POSSIBILITIES; CYANURIC ACID; STM images Scanning Scanning Tunneling Microscopy (stm) Scanning force microscopy Scanning tunneling microscopy Spheres Spherical particle Strong binding Structure formations Superconductivity Surface defects, Dewatering Surface vacancies Systematic study T junctions, Block copolymers Technological process Thymine TiO, Adsorbates Viruses, Computer simulation Water Water adsorption Water molecule, Adsorption article atmosphere atomic force microscopy atomic scale corrugation contrast formation crystal structure density functional theory dipole energy localization entropic gain flat organic molecules flat periodic patterns graded Lie algebra graded Lie algebra of maximal class hydrogen bond hydronium ion ice interactions life low-dimensional tori manipulation motifs naphthalene perylene priority journal, Acids proton, acidity replication self-assembly solid surfaces superconductivity thin Lie algebra water

Number of items: 133.

Ab initio calculations

Pang, C. L., Watkins, Matthew, Cabailh, G., Ferrero, S., Ngo, L. T., Chen, Q., Humphrey, D. S., Shluger, A. L. and Thornton, G. (2010) Bonding of methyl phosphonate to TiO2(110). Journal of Physical Chemistry C, 114 (40). pp. 16983-16988. ISSN 1932-7447

Ab initio simulations

Lardge, Jennifer S., Duffy, Dorothy M., Gillan, Mike J. and Watkins, Matthew (2010) Ab initio simulations of the interaction between water and defects on the calcite (101-4) surface. Journal of Physical Chemistry C, 114 (6). pp. 2664-2668. ISSN 19327447

Adsorbed water

Anion vacancy

Associated Lie ring

Khukhro, Evgeny (2010) Fixed points of the complements of Frobenius groups of automorphisms. Siberian Mathematical Journal, 51 (3). pp. 552-556. ISSN 0037-4466

Atomic force microscopy

Au(111) surface

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Xu, Wei, Wang, Jian-guo, Jacobsen, Mikkel F., Mura, Manuela, Yu, Miao, Kelly, Ross E. A., Meng, Qiang-qiang, Laegsgaard, Erik, Stensgaard, Ivan, Linderoth, Trolle R., Kjems, Jørgen, Kantorovich, Lev N., Gothelf, Kurt V. and Besenbacher, Flemming (2010) Supramolecular porous network formed by molecular recognition between chemically modified nucleobases guanine and cytosine. Angewandte Chemie International Edition, 49 (49). pp. 9373-9377. ISSN 1433-7851

Automorphism

Khukhro, Evgeny (2010) Fixed points of the complements of Frobenius groups of automorphisms. Siberian Mathematical Journal, 51 (3). pp. 552-556. ISSN 0037-4466

Binomial transform

Mattarei, Sandro and Tauraso, Roberto (2010) Congruences of multiple sums involving sequences invariant under the binomial transform. Journal of Integer Sequences, 13 (5). Article 10.5.1. ISSN 1530-7638

Block copolymer films

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Block-cut-vertex tree

Smith, Simon (2010) Infinite primitive directed graphs. Journal of Algebraic Combinatorics, 31 (131). ISSN 0925-9899

Brownian Dynamics

Ramírez, Jorge, Sukumaran, Sathish K., Vorselaars, Bart and Likhtman, Alexei E. (2010) Efficient on the fly calculation of time correlation functions in computer simulations. The Journal of Chemical Physics, 133 (15). p. 154103. ISSN 0021-9606

Calcite

Calcite surface

Carbonate minerals

Carboxylation

Cation vacancies

Cell dynamics

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Computational methods

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Computer simulation

Congruences

Copolymerization

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Correlation function

Cylinders (shapes)

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

DENSITY-FUNCTIONAL THEORY; GENERALIZED GRADIENT APPROXIMATION; SCANNING-TUNNELING-MICROSCOPY; SUPRAMOLECULAR STRUCTURES; HYDROGEN; ADSORPTION; NETWORK; NANOSTRUCTURES; ORGANIZATION; MONOLAYERS

Mura, M., Gulans, A., Thonhauser, T. and Kantorovich, L. (2010) Role of van der Waals interaction in forming molecule-metal junctions: flat organic molecules on the Au(111) surface. Physical Chemistry Chemical Physics, 12 (18). p. 4759. ISSN 1463-9076

Density functional theory

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Density functional theory calculations

Electrostatics

Paillusson, Fabien and Blossey, Ralf (2010) Slits, plates, and Poisson-Boltzmann theory in a local formulation of nonlocal electrostatics. Physical Review E, 82 (5). ISSN 1539-3755

Energy position

Fermi-Pasta-Ulam

Christodoulidi, H, Efthymiopoulos, C. and Bountis, T. (2010) Energy localization onq-tori, long-term stability, and the interpretation of Fermi-Pasta-Ulam recurrences. Physical Review E, 81 (1). ISSN 2470-0045

Film interfaces

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Frobenius group

Khukhro, Evgeny (2010) Fixed points of the complements of Frobenius groups of automorphisms. Siberian Mathematical Journal, 51 (3). pp. 552-556. ISSN 0037-4466

Gas-phase analysis

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Golf balls

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Hydrogen Bonding

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

Hydrogen bonds

Hydroxide ions

Hydroxides

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

Infinite permutation groups

Smith, Simon (2010) Infinite primitive directed graphs. Journal of Algebraic Combinatorics, 31 (131). ISSN 0925-9899

Inorganic surfaces

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

Integer sequences

Interface

Ions

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

Lattice parameters

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Low energy electron diffraction

Metal surfaces

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Model system

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Modular Lie algebra

Avitabile, Marina, Jurman, Giuseppe and Mattarei, Sandro (2010) The structure of thin Lie algebras with characteristic two. International Journal of Algebra and Computation, 20 (06). pp. 731-768. ISSN 0218-1967

Molecular dynamics

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

Molecules

Multiple sums

Nanobeads

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Nanocapsules

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Nanocontainers

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Nanotubes

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Nilpotent group

Khukhro, Evgeny (2010) Fixed points of the complements of Frobenius groups of automorphisms. Siberian Mathematical Journal, 51 (3). pp. 552-556. ISSN 0037-4466

Noncontact atomic force microscopy

Orbital graph

Smith, Simon (2010) Infinite primitive directed graphs. Journal of Algebraic Combinatorics, 31 (131). ISSN 0925-9899

Organic acids

Oxide minerals, Scanning tunneling microscopy

PTCDA; AU(111) SURFACE; METAL-SURFACES; NETWORKS; MELAMINE; GROWTH

Mura, M., Sun, X., Silly, F., Jonkman, H. T., Briggs, G. A. D., Castell, M. R. and Kantorovich, L. N. (2010) Experimental and theoretical analysis of H-bonded supramolecular assemblies of PTCDA molecules. Physical Review B, 81 (19). ISSN 1098-0121

Particle radii

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Permutation groups

Smith, Simon (2010) Subdegree growth rates of infinite primitive permutation groups. Journal of the London Mathematical Society, 82 (2). pp. 526-548. ISSN 0024-6107

Phosphonates

Phosphonic acids

Planar structures

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

Plastic products

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Poincaré-Lindstedt method

Potential energy

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

Primitive

Smith, Simon (2010) Subdegree growth rates of infinite primitive permutation groups. Journal of the London Mathematical Society, 82 (2). pp. 526-548. ISSN 0024-6107

Primitive digraph

Smith, Simon (2010) Infinite primitive directed graphs. Journal of Algebraic Combinatorics, 31 (131). ISSN 0925-9899

Primitive graph

Smith, Simon (2010) Infinite primitive directed graphs. Journal of Algebraic Combinatorics, 31 (131). ISSN 0925-9899

Protons

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

Rutile TiO

SCANNING-TUNNELING-MICROSCOPY; ORGANIC THIN-FILM; HOMOPAIRING POSSIBILITIES; CYANURIC ACID;

STM images

Scanning

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Scanning Tunneling Microscopy (stm)

Scanning force microscopy

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Scanning tunneling microscopy

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Spheres

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Spherical particle

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Strong binding

Structure formations

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Superconductivity

Cudazzo, P., Profeta, G., Sanna, A., Floris, A., Continenza, A., Massidda, S. and Gross, E. K. U. (2010) Electron-phonon interaction and superconductivity in metallic molecular hydrogen. I. Electronic and dynamical properties under pressure. Physical Review B, 81 (13). ISSN 2469-9950

Surface defects, Dewatering

Surface vacancies

Systematic study

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

T junctions, Block copolymers

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Technological process

Thymine

TiO, Adsorbates

Viruses, Computer simulation

Pinna, Marco, Hiltl, Stephanie, Guo, Xiaohu, Böker, Alexander and Zvelindovsky, Andrei (2010) Block copolymer nanocontainers. ACS Nano, 4 (5). pp. 2845-2855. ISSN 1936-0851

Water

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

Water adsorption

Water molecule, Adsorption

article

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

atmosphere

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

atomic force microscopy

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

atomic scale corrugation

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

contrast formation

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

crystal structure

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

density functional theory

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

dipole

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

energy localization

entropic gain

Watkins, Matthew and Shluger, Alexander L. (2010) Mechanism of contrast formation in atomic force microscopy in water. Physical Review Letters, 105 (19). ISSN 0031-9007

flat organic molecules

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

flat periodic patterns

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

graded Lie algebra

graded Lie algebra of maximal class

hydrogen bond

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

hydronium ion

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

ice

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

interactions

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

life

low-dimensional tori

manipulation

motifs

naphthalene

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

perylene

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

priority journal, Acids

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

proton, acidity

Watkins, Matthew, VandeVondele, Joost and Slater, Ben (2010) Point defects at the ice (0001) surface. Proceedings of the National Academy of Sciences, 107 (28). pp. 12429-12434. ISSN 0027-8424

replication

self-assembly

Mura, Manuela (2010) Self-assembly of flat organic molecules on metal surfaces: a theoretical characterisation. PhD thesis, King's College, London.

solid surfaces

superconductivity

Cudazzo, P., Profeta, G., Sanna, A., Floris, A., Continenza, A., Massidda, S. and Gross, E. K. U. (2010) Electron-phonon interaction and superconductivity in metallic molecular hydrogen. II. Superconductivity under pressure. Physical Review B, 81 (13). ISSN 2469-9950

thin Lie algebra

water

Paillusson, Fabien and Blossey, Ralf (2010) Slits, plates, and Poisson-Boltzmann theory in a local formulation of nonlocal electrostatics. Physical Review E, 82 (5). ISSN 1539-3755

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