S. Jenkins

发表

S. Ichimura, Christian K. Fink, Ken Nakamura, 2009, Journal of physics. Condensed matter : an Institute of Physics journal.

Theory of Methane Dehydrogenation on Pt{110}(1 × 2). Part II: Microscopic Reaction Pathways for CHx → CHx-1 (x = 1−3)

D. King, S. Jenkins, M. Petersen, 2004 .

Car exhaust catalysis from first principles: selective NO reduction under excess O2 conditions on Ir.

D. King, Zhipan Liu, S. Jenkins, 2004, Journal of the American Chemical Society.

Pathways for dissociative methane chemisorption on Pt{110}-(1×2)

D. Wales, D. King, S. Jenkins, 2005 .

Dynamic interplay between diffusion and reaction: nitrogen recombination on Rh{211} in car exhaust catalysis.

D. King, Oliver Richard Inderwildi, S. Jenkins, 2008, Journal of the American Chemical Society.

Theoretical stoichiometry and surface states of a semi-heusler alloy

S. Jenkins, 2005 .

Mechanistic studies of hydrocarbon combustion and synthesis on noble metals.

D. King, Oliver Richard Inderwildi, S. Jenkins, 2008, Angewandte Chemie.

Search for Electron Antineutrino Appearance in a Long-Baseline Muon Antineutrino Beam.

M. Hartz, K. McFarland, Y. Nagai, 2019, Physical review letters.

Oxygen vacancy clusters on ceria: Decisive role of cerium f electrons

A. Michaelides, D. King, S. Jenkins, 2009 .

Ir-induced activation of Au towards CO adsorption: Ir films deposited on Au{111}

D. King, S. Jenkins, S. J. Pratt, 2016 .

Bond-selective energy redistribution in the chemisorption of CH3D and CD3H on Pt{1 1 0}-(1 × 2): A first-principles molecular dynamics study

D. Wales, M. Sacchi, S. Jenkins, 2012 .

First combined measurement of the muon neutrino and antineutrino charged-current cross section without pions in the final state at T2K

Tejpreet Singh Golan, M. Hartz, K. McFarland, 2020, Physical Review D.

Activity of iron pyrite towards low-temperature ammonia production

Tao Liu, S. Jenkins, I. Temprano, 2017 .

T2K measurements of muon neutrino and antineutrino disappearance using $3.13\times 10^{21}$ protons on target

M.Ikeda, M. Hartz, K. McFarland, 2020, 2008.07921.

Fischer-Tropsch synthesis of liquid fuels: learning lessons from homogeneous catalysis.

D. King, Oliver Richard Inderwildi, S. Jenkins, 2009, Physical chemistry chemical physics : PCCP.

In‐silico Investigations in Heterogeneous Catalysis—Combustion and Synthesis of Small Alkanes

Oliver Richard Inderwildi, S. Jenkins, 2009 .

Dipole Moment Reversal in a Polar Organic Monolayer Probed by Sum and Difference Frequency Spectroscopy

M. Sacchi, S. Jenkins, N. Rey, 2017 .

First-principles molecular dynamics of the initial oxidation of Si{001} by ozone

Christian K. Fink, S. Jenkins, 2008 .

First-Principles Dynamics of Fluorine Adsorption on Clean and Monohydrogenated Si{001}

S. Jenkins, ian-Yun Wu, 2022, Langmuir : the ACS journal of surfaces and colloids.

Infrared Spectroscopy of Ammonia on Iron: Thermal Stability and the Influence of Potassium

D. King, S. Jenkins, David C. Madden, 2014 .

Positive charge States and possible polymorphism of gold nanoclusters on reduced ceria.

A. Michaelides, D. King, S. Jenkins, 2010, Journal of the American Chemical Society.

Ridge-bridge adsorption of molecular oxygen on Pt[110](1 x 2) from first principles.

D. King, S. Jenkins, M. Petersen, 2006, The journal of physical chemistry. B.

Comparative ab initio pseudopotential studies of group V overlayers on Si(001)

G. P. Srivastava, S. Gay, S. Jenkins, 1998 .

Ab-initio density functional calculations for Si(001)/Bi(1 ML)-(2×1)

G. P. Srivastava, S. Jenkins, 1998 .

Ab initio calculation of geometry and bonding for overlaid and inlaid models of Si(001)/Sb(0.25ML)-c(4×4)

G. P. Srivastava, C. McConville, S. Jenkins, 1998 .

Structural studies of Si(001)/Sb(0.25 ML)-c(4 × 4)

G. P. Srivastava, S. Jenkins, 1998 .

Why is silver catalytically active for NO reduction? A unique pathway via an inverted (NO)2 dimer.

D. King, Zhipan Liu, S. Jenkins, 2004, Journal of the American Chemical Society.

Role of nanostructured dual-oxide supports in enhanced catalytic activity: theory of CO oxidation over Au/IrO2/TiO2.

D. King, Zhipan Liu, S. Jenkins, 2004, Physical review letters.

Anchoring Sites for Initial Au Nucleation on CeO2{111}: O Vacancy versus Ce Vacancy

A. Michaelides, D. King, S. Jenkins, 2009 .

Theory of NO/K phase mixing, separation and catalytic promoter action on Co{1 0 1 0}

D. King, S. Jenkins, 2003 .

Is there in truth no beauty

S. Jenkins, 1998 .

Catalyst-induced changes in a substituted aromatic: A combined approach via experiment and theory

D. King, Y. Tan, S. Jenkins, 2005 .

Motion of water monomers reveals a kinetic barrier to ice nucleation on graphene

A. Jardine, Jian-Hui Zhu, P. Fouquet, 2018, Nature Communications.

Water and ammonia on Cu{110}: comparative structure and bonding.

Glenn Jones, S. Jenkins, 2013, Physical chemistry chemical physics : PCCP.

Benzene and Its Dissociation Products on Ir{100}

D. King, S. Jenkins, S. Yamagishi, 2008 .

Origin and consequences of aromatic back-bonding at a transition metal surface: Benzyne on Ir{100}

D. King, S. Jenkins, S. Yamagishi, 2002 .

In-silico investigations in heterogeneous catalysis--combustion and synthesis of small alkanes.

Oliver Richard Inderwildi, S. Jenkins, 2008, Chemical Society reviews.

Theory of C2Hx species on Pt{110} (1x2): reaction pathways for dehydrogenation.

D. Wales, D. King, S. Jenkins, 2007, The Journal of chemical physics.

Pathways for dissociative ethane chemisorption on Pt{1 1 0} (1 × 2) using density functional theory

D. Wales, D. King, S. Jenkins, 2005 .

Origin and activity of oxidized gold in water-gas-shift catalysis.

D. King, Zhipan Liu, S. Jenkins, 2005, Physical review letters.

Interface effects in spin-polarized metal/insulator layered structures

E. Tsymbal, J. Velev, P. Dowben, 2008 .

Beyond the surface atlas: A roadmap and gazetteer for surface symmetry and structure

S. Jenkins, S. J. Pratt, 2007 .

Rotational Dynamics of Desorption: Methane and Ethane at Stepped and Kinked Platinum Surfaces

D. Wales, S. Jenkins, S. Matysik, 2021, The Journal of Physical Chemistry C.

Crystallography of Surfaces

S. Jenkins, 2020, Springer Handbook of Surface Science.

Symmetry and Structure of Cubic Semiconductor Surfaces.

S. Jenkins, 2017, Langmuir : the ACS journal of surfaces and colloids.

Spontaneous Local Symmetry Breaking: A Conformational Study of Glycine on Cu{311}

M. Sacchi, S. Jenkins, I. Temprano, 2015 .

On the role of molecular chirality in amino acid self-organisation on Cu{311}

S. Jenkins, S. Driver, D. C. Madden, 2014 .

Structure and stress of Re(1121); chiral terraces at a racemic surface.

G. Held, S. Jenkins, R. Bennett, 2013, Physical chemistry chemical physics : PCCP.

Dissociative Chemisorption of Hydrazine on an Fe{211} Surface

D. Wales, S. Jenkins, Hayley McKay, 2011 .

Near-degenerate stereomorphs of the doubly-chiral hcp-{213̅1} surface

S. Jenkins, 2010 .

Aromatic adsorption on metals via first-principles density functional theory

S. Jenkins, 2009, Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences.

Surface geometry of Cu{531}

M. J. Gladys, Glenn Jones, G. Held, 2009 .

Adsorbate influence on the coercive field of ultrathin Co/Cu{1 1 0}

J. Bland, S. Jenkins, D. Gunn, 2009 .

Facile dissociation of CO on Fe{211} : Evidence from microcalorimetry and first-principles theory

V. Fiorin, David Borthwick, D. King, 2008 .

Hydrogen bonds at metal surfaces: Universal scaling and quantification of substrate effects

D. A. King, Glenn Jones, D. King, 2006 .

The Structure of the Chiral Pt{531} Surface: A Combined LEED and DFT Study

D. King, E. Mola, G. Held, 2005 .

The symmetry and structure of crystalline surfaces

D. King, S. Jenkins, S. J. Pratt, 2005 .

Comparative theory of missing-row reconstructions: Pt{110}, Pt{211} and Pt{311}

D. King, S. Jenkins, M. Petersen, 2001 .

Energy landscapes and dynamics of glycine on Cu(110).

D. Wales, M. Sacchi, S. Jenkins, 2017, Physical chemistry chemical physics : PCCP.

Proline-Derived Structural Phases on Cu{311}

S. Jenkins, S. Driver, I. Temprano, 2015, Topics in Catalysis.

The local adsorption geometry and electronic structure of alanine on Cu{110}

L. B. Jones, Glenn Jones, G. Held, 2006 .

Chirality at Solid Surfaces

S. Jenkins, 2018 .

The importance of attractive three-point interaction in enantioselective surface chemistry: stereospecific adsorption of serine on the intrinsically chiral Cu{531} surface.

G. Held, S. Jenkins, A. Shavorskiy, 2012, Journal of the American Chemical Society.

Stabilizing CO on Au with NO2: electronegative species as promoters on coinage metals?

Zhi-Pan Liu, Tianfu Zhang, D. King, 2005, Physical review letters.

Driving forces for self-organized coadsorption: C6H6/2O and C6H6/2CO on Ni[111].

D. King, S. Jenkins, S. Yamagishi, 2004, Journal of the American Chemical Society.

Dissociative adsorption and adsorbate-induced reconstruction on Fe{2 1 1}

S. Jenkins, 2006 .

Self-Organized Overlayers Formed by Alanine on Cu{311} Surfaces

M. Blanco-Rey, M. Sacchi, S. Jenkins, 2014 .

Co-adsorption of water and glycine on Cu{110}.

M. Sacchi, S. Jenkins, 2014, Physical chemistry chemical physics : PCCP.

Dynamic Diastereomerism on Chiral Surfaces

D. Wales, S. Jenkins, S. Matysik, 2022, The journal of physical chemistry. C, Nanomaterials and interfaces.

Surface Chirality Influences Molecular Rotation upon Desorption.

D. Wales, S. Jenkins, S. Matysik, 2021, Physical review letters.

First-principles theory and microcalorimetry of CO adsorption on the {211} surfaces of Pt and Ni

V. Fiorin, D. King, S. Jenkins, 2003 .

Supramolecular self-assembled network formation containing N···Br halogen bonds in physisorbed overlayers.

S. Clarke, J. Parker, M. Sacchi, 2014, Physical chemistry chemical physics : PCCP.

Adsorbate/substrate bonding in Co{100}/K-c(2×2) elucidated through first-principles theory

D. King, S. Jenkins, 2000 .

Surface infra-red emission during alkali-metal incorporation at an oxide surface [rapid communication]

D. King, S. Jenkins, Y. Hou, 2004 .

Infrared Spectroscopy of Ammonia on Iron: Adsorption, Synthesis, and the Influence of Oxygen

D. King, S. Jenkins, Poobalasuntharam Iyngaran, 2017 .

Hydrogenation of N over Fe{111}

D. King, S. Jenkins, Poobalasuntharam Iyngaran, 2010, Proceedings of the National Academy of Sciences.

Chapter 8 - Spin-polarised surfaces: Current state of Density Functional Theory investigations

S. Jenkins, 2004 .

Direct Correlation between Adsorption Energetics and Nuclear Spin Relaxation in a Liquid-saturated Catalyst Material.

L. Gladden, S. Jenkins, C. D’Agostino, 2018, Chemphyschem : a European journal of chemical physics and physical chemistry.

First T2K measurement of transverse kinematic imbalance in the muon-neutrino charged-current single- π+ production channel containing at least one proton

M. Hartz, K. McFarland, Y. Nagai, 2021, Physical Review D.

Measurements of $\overline{\nu}_{\mu}$ and $\overline{\nu}_{\mu} + \nu_{\mu}$ charged-current cross-sections without detected pions or protons on water and hydrocarbon at a mean anti-neutrino energy of 0.86 GeV

M. Hartz, K. McFarland, Y. Nagai, 2020, Progress of Theoretical and Experimental Physics.

Epitaxial growth of few-layer MoS2(0001) on FeS2{100}.

D. King, S. Jenkins, Tianyu Liu, 2015, Chemical communications.

First measurement of the charged current ν¯μ double differential cross section on a water target without pions in the final state

M. Hartz, K. McFarland, Y. Nagai, 2019, Physical Review D.

Neutron-antineutron oscillation search using a 0.37 megaton-years exposure of Super-Kamiokande

M. Hartz, K. Nakamura, K. Sato, 2021, Physical Review D.

Simultaneous measurement of the muon neutrino charged-current cross section on oxygen and carbon without pions in the final state at T2K

M. Hartz, K. McFarland, Y. Nagai, 2020, Physical Review D.

Measurement of the charged-current electron (anti-)neutrino inclusive cross-sections at the T2K off-axis near detector ND280

Tejpreet Singh Golan, M. Hartz, K. McFarland, 2020, Journal of High Energy Physics.

Theoretical evidence concerning mixed dimer growth on the surface

G. P. Srivastava, S. Jenkins, 1996 .

Minority metallic surface states of a half-metallic ferrimagnet

D. King, S. Jenkins, 2001 .

The Limits to Spin-Polarization in Finite-Temperature Half-Metallic Ferromagnets

P. Dowben, S. Jenkins, 2005 .

Repulsion-Induced Surface-Migration by Ballistics and Bounce.

J. Polanyi, M. Sacchi, S. Jenkins, 2015, The journal of physical chemistry letters.

Surface states and surface stability in half-metallic systems: the cases of zinc-blende-structure MnSb {111}A, {111}B and {001}

S. Jenkins, S. Mollet, 2007, Journal of physics. Condensed matter : an Institute of Physics journal.

Ternary half-metallics and related binary compounds: Stoichiometry, surface states, and spin

S. Jenkins, 2004 .

Formation of interface states on a half-metal surface

D. King, S. Jenkins, 2002 .

Electronic Structure and Bonding of an Ionic Molecular Adsorbate: c-C5H5 on Cu{111}

A. Jardine, M. Sacchi, H. Hedgeland, 2011 .

Non-dissociative activation of chemisorbed dinitrogen on Ni{110} by co-adsorbed lithium.

D. King, Tao Liu, S. Jenkins, 2013, The Journal of chemical physics.

Thermodynamic evidence for surfactant behaviour of Sb in the growth of Ge on Si(001)

G. P. Srivastava, S. Jenkins, 1998 .

Fischer−Tropsch Mechanism Revisited: Alternative Pathways for the Production of Higher Hydrocarbons from Synthesis Gas

Oliver R. Inderwildi, David A. King, D. King, 2008 .

Hydrogen on Graphene Under Stress: Molecular Dissociation and Gap Opening

D. Wales, S. Jenkins, J. A. Vergés, 2010, 1106.0385.

Mass Transport in Surface Diffusion of van der Waals Bonded Systems: Boosted by Rotations?

A. Jardine, M. Sacchi, D. Ward, 2016, The journal of physical chemistry letters.

Theory of Methane Dehydrogenation on Pt{110}(1 × 2). Part I: Chemisorption of CHx (x = 0 −3)

D. King, S. Jenkins, M. Petersen, 2004 .

Measurement of neutrino and antineutrino neutral-current quasielasticlike interactions on oxygen by detecting nuclear deexcitation gamma rays

M. Hartz, T. Maruyama, K. McFarland, 2019, 1910.09439.

The interaction of iron pyrite with oxygen, nitrogen and nitrogen oxides: a first-principles study.

M. Sacchi, S. Jenkins, M. Galbraith, 2012, Physical chemistry chemical physics : PCCP.

Supernova model discrimination with Hyper-Kamiokande

M. Hartz, S. Kim, K. Nakamura, 2019, 2002.01649.

First principles studies of chemisorbed O on Ni{1 1 1}

D. King, S. Jenkins, S. Yamagishi, 2003 .

Long-range ordering of methylidyne on Pt{110}(1×2)

D. King, S. Jenkins, M. Petersen, 2002 .

Lifting of Ir{100} reconstruction by CO adsorption: an ab initio study.

P. Ghosh, D. King, S. Narasimhan, 2007, The Journal of chemical physics.

Theory of CO adsorption on Co

D. King, S. Jenkins, 2002 .

Jumping, Rotating, and Flapping: The Atomic-Scale Motion of Thiophene on Cu(111).

P. Dastoor, A. Jardine, M. Sacchi, 2013, The journal of physical chemistry letters.

Adsorbate modification of the structural, electronic, and magnetic properties of ferromagnetic fcc {110} surfaces

S. Jenkins, D. Gunn, 2011 .

Pentaprismane and hypostrophene from first-principles, with plane waves

S. Jenkins, D. A. King, 2000 .

Localisation of adsorbate-induced demagnetisation: CO chemisorbed on Ni{110}

D. King, Q. Ge, S. Jenkins, 2000 .

An ab initio pseudopotential calculation of ground-state and excited-state properties of gallium nitride

G. P. Srivastava, S. Jenkins, J. C. Inkson, 1994 .

Density functional and quasi-particle calculations on the InP(110) surface

G. P. Srivastava, S. Jenkins, J. C. Inkson, 1996 .

Density functional and quasiparticle calculations on the GaP(110) surface

G. P. Srivastava, S. Jenkins, J. C. Inkson, 1995 .

A study of atomic vibrations on Si(001)/Sb(2×1)

G. P. Srivastava, S. Jenkins, H. M. Tütüncü, 1998 .

Bonding and structure of the Si(001)(2 × 1)-Sb surface

G. P. Srivastava, S. Jenkins, 1996 .

Theoretical studies of atomic vibrations on the Si(001)(2×1) surface

G. P. Srivastava, S. Jenkins, H. M. Tütüncü, 1997 .

Structure and energetics of segregated and nonsegregated Ge(001)/Si(2×1)

G. P. Srivastava, S. Jenkins, 1998 .

Electrostatic implications for Sb-mediated growth of Ge on the Si(001) surface

G. P. Srivastava, S. Jenkins, 1997 .

Structure and stability of the Si(001)c(4×4)-Sb surface

G. P. Srivastava, C. McConville, S. Jenkins, 1998 .

Electronic structure of a stepped semiconductor surface: Density functional theory ofSi(114)−(2×1)

G. P. Srivastava, S. Jenkins, R. D. Smardon, 2004 .

Energetic evidence for mixed dimer growth on the surface

G. P. Srivastava, S. Jenkins, 1997 .

A study of atomic vibrations on Si(001)(2 × 1)Ge

G. P. Srivastava, S. Jenkins, H. M. Tütüncü, 1998 .

Atomic geometry, electronic structure, and vibrational properties of the Ge(001)(2×1) surface

G. P. Srivastava, S. Jenkins, H. M. Tütüncü, 1998 .

Comparative study of Sb bonding on group-IV semiconductor (001) substrates

G. P. Srivastava, S. Jenkins, 1997 .

Low Temperature Synthesis of NH3 from Atomic N and H at the Surfaces of FeS2{100} Crystals

D. King, S. Jenkins, Tao Liu, 2013 .

Nitrogen adsorption and desorption at iron pyrite FeS2{100} surfaces.

D. King, S. Jenkins, Tao Liu, 2012, Physical chemistry chemical physics : PCCP.

2D constraint modifies packing behaviour: a halobenzene monolayer with X3 halogen-bonding motif

S. Clarke, F. Gorrec, S. Jenkins, 2021, Molecular physics.

C–H … N hydrogen bonding in an overlayer of s-triazine physisorbed on a graphite surface

S. Clarke, F. Gorrec, S. Jenkins, 2019, Molecular physics.

Theory of gold on ceria.

A. Michaelides, S. Jenkins, C. Zhang, 2011, Physical chemistry chemical physics : PCCP.

Structure of gold atoms on stoichiometric and defective ceria surfaces.

A. Michaelides, D. King, S. Jenkins, 2008, The Journal of chemical physics.

The crystalline structure of the phenazine overlayer physisorbed on a graphite surface

S. Clarke, J. Parker, M. Sacchi, 2013 .

Ozonolysis of diamond

Christian K. Fink, S. Jenkins, 2009, Journal of physics. Condensed matter : an Institute of Physics journal.

Step-enhanced selectivity of NO reduction on platinum-group metals.

D. King, Zhipan Liu, S. Jenkins, 2003, Journal of the American Chemical Society.

Combined Diffraction and Density Functional Theory Calculations of Halogen-Bonded Cocrystal Monolayers

S. Clarke, T. Friščić, J. Parker, 2013, Langmuir : the ACS journal of surfaces and colloids.

Mechanisms for H2 Reduction on the PdO{101} Surface and the Pd{100}-(√5 × √5)R27°-O Surface Oxide

D. Wales, M. Blanco-Rey, S. Jenkins, 2009 .

Insight into the reduction of pyruvic acid to lactic acid over Cu{110}: the crucial role of intramolecular tunneling in direct hydrogenation.

Glenn Jones, S. Jenkins, 2008, Journal of the American Chemical Society.

Quantum influences in the diffusive motion of pyrrole on Cu(111).

M. Sacchi, H. Hedgeland, W. Allison, 2013, Angewandte Chemie.

Surface stress in d-band metal surfaces

M. Blanco-Rey, S. Jenkins, 2010, Journal of physics. Condensed matter : an Institute of Physics journal.

Mode-specificity and transition state-specific energy redistribution in the chemisorption of CH4 on Ni{100}.

D. Wales, M. Sacchi, S. Jenkins, 2012, Physical chemistry chemical physics : PCCP.

Mode-specific chemisorption of CH4 on Pt{110}-(1 x 2) explored by first-principles molecular dynamics

D. Wales, M. Sacchi, S. Jenkins, 2011 .

Comparative study of single-atom gold and iridium on CeO2{111}.

Cameron J. Owen, S. Jenkins, 2021, The Journal of chemical physics.

Radical-mediated adsorption: Ozone oxidation of passivated silicon

Christian K. Fink, S. Jenkins, 2008 .

Weak intermolecular interactions in an ionically bound molecular adsorbate: cyclopentadienyl/Cu(111).

A. Jardine, M. Sacchi, H. Hedgeland, 2011, Physical review letters.

Methane dissociation and methyl diffusion on PdO{100}.

M. Blanco-Rey, S. Jenkins, Stephen J. Jenkins, 2009, The Journal of chemical physics.

Single-crystal adsorption calorimetry and density functional theory of CO chemisorption on fcc Co{110}.

V. Fiorin, D. King, S. Jenkins, 2013, Physical chemistry chemical physics : PCCP.

The dehydrogenation of butane on metal-free graphene.

S. Wrabetz, J. McGregor, M. Sacchi, 2022, Journal of colloid and interface science.

A tilt-dependent diffusional potential energy landscape: benzyne on Ir{1 0 0}

D. King, S. Jenkins, S. Yamagishi, 2003 .

When adding an unreactive metal enhances catalytic activity: NOx decomposition over silver–rhodium bimetallic surfaces

D. King, Oliver Richard Inderwildi, S. Jenkins, 2007 .

Increased thermal stability of activated N2 adsorbed on K-promoted Ni{110}.

S. Jenkins, Tao Liu, I. Temprano, 2017, Physical chemistry chemical physics : PCCP.

The importance of attractive three-point interaction in enantioselective surface chemistry: stereospecific adsorption of serine on the intrinsically chiral Cu{531} surface.

G. Held, S. Jenkins, A. Shavorskiy, 2012, Journal of the American Chemical Society.

Water and ammonia on Cu{110}: comparative structure and bonding.

Glenn Jones, S. Jenkins, 2013, Physical chemistry chemical physics : PCCP.

Phonon modes for the symmetric and asymmetric dimer models of the Si(001)(2 × 1) surface

G. P. Srivastava, S. Jenkins, H. M. Tütüncü, 1997 .

Comment on: New electron states that float on semiconductor and metal surfaces [Surf. Sci. 585 (2005) L177]

S. Jenkins, 2006 .