Journal of Chemical Physics, 0021-9606

Journal

Publications

  1. 2018
  2. Published
  3. 2017
  4. Published

    Using a direct simulation Monte Carlo approach to model collisions in a buffer gas cell

    Tim Softley, 28 Jan 2017, In: Journal of Chemical Physics. 146, 4, 044302.

    Research output: Contribution to journalArticlepeer-review

  5. 2016
  6. E-pub ahead of print

    Note: Production of silver nanoclusters using a Matrix-Assembly Cluster Source with a solid CO2 matrix

    Vitor Oiko, Lu Cao & Richard Palmer, 24 Oct 2016, In: Journal of Chemical Physics. 145, 16, 166101.

    Research output: Contribution to journalArticlepeer-review

  7. Published

    Handshake electron transfer from hydrogen Rydberg atoms incident at a series of metallic thin films

    Tim Softley, 21 Jun 2016, In: Journal of Chemical Physics. 144, 23, 234703.

    Research output: Contribution to journalArticlepeer-review

  8. E-pub ahead of print

    Optimisation of simulations of stochastic processes by removal of opposing reactions

    Fabian Spill, 24 Feb 2016, In: Journal of Chemical Physics. 144, 8, 084105.

    Research output: Contribution to journalArticlepeer-review

  9. Published
  10. 2015
  11. Published

    The effects of intrinsic noise on the behaviour of bistable cell regulatory systems under quasi-steady state conditions

    Fabian Spill, 19 Aug 2015, In: Journal of Chemical Physics. 143, 7, 14 p., 074105.

    Research output: Contribution to journalArticlepeer-review

  12. Published
  13. Published

    Diffusion anisotropy of poor metal solute atoms in hcp-Ti

    Alessandro Mottura, 28 May 2015, In: Journal of Chemical Physics. 142, 20, 204308.

    Research output: Contribution to journalArticlepeer-review

  14. Published
  15. Published
  16. Published

    Which way up? Recognition of homologous DNA segments in parallel and antiparallel alignments

    Tim Albrecht, 2015, In: Journal of Chemical Physics. 142, 4, 045101.

    Research output: Contribution to journalArticlepeer-review

  17. 2014
  18. Published

    Comparative modelling of chemical ordering in palladium-iridium nanoalloys

    Roy Johnston, 14 Dec 2014, In: Journal of Chemical Physics. 141, 22, 224307.

    Research output: Contribution to journalArticlepeer-review

  19. Published

    Global minimum search of Ag+10 with molecular beam optical spectroscopy

    Roy Johnston, 14 Nov 2014, In: Journal of Chemical Physics. 141, 18, 181104.

    Research output: Contribution to journalArticlepeer-review

  20. Published
  21. Published

    Influence of spin-orbit effects on structures and dielectric properties of neutral lead clusters

    Roy Johnston, 28 Apr 2014, In: Journal of Chemical Physics. 140, 16, 164313.

    Research output: Contribution to journalArticlepeer-review

  22. Published

    Laser induced rovibrational cooling of the linear polyatomic ion C2H2(+).

    Tim Softley, 1 Apr 2014, In: Journal of Chemical Physics. 140, p. 164314 1 p.

    Research output: Contribution to journalArticlepeer-review

  23. Published

    Getting a grip on the transverse motion in a Zeeman decelerator.

    Tim Softley, 1 Mar 2014, In: Journal of Chemical Physics. 140, p. 104201 1 p.

    Research output: Contribution to journalArticlepeer-review

  24. Published

    Optical and electronic properties of mixed Ag-Au tetramer cations

    Roy Johnston, 7 Feb 2014, In: Journal of Chemical Physics. 140, 5, 054312.

    Research output: Contribution to journalArticlepeer-review

  25. Published

    A reinterpretation of the electronic spectrum of pyrrole: a quantum dynamics study

    Simon Neville & Graham Worth, 21 Jan 2014, In: Journal of Chemical Physics. 140, 3, 13 p., 034317.

    Research output: Contribution to journalArticlepeer-review

  26. 2013
  27. Published

    Modelling the metal-on-top effect for Pd clusters on the MgO{100} substrate

    Ivailo Atanasov & Roy Johnston, 14 Jun 2013, In: Journal of Chemical Physics. 138, 22, p. 224703

    Research output: Contribution to journalArticlepeer-review

  28. Published

    Vibrational and electronic excitations in fluorinated ethene cations from the ground up

    Richard Tuckett, 28 Mar 2013, In: Journal of Chemical Physics. 138, 12, 124301.

    Research output: Contribution to journalArticlepeer-review

  29. Published
  30. 2012
  31. Published
  32. Published

    Probing the buried C-60/Au(111) interface with atoms

    Quanmin Guo, 2012, In: Journal of Chemical Physics. 214706.

    Research output: Contribution to journalArticlepeer-review

  33. 2011
  34. Published

    Complex orientational ordering of C(60) molecules on Au(111).

    Lin Tang & Quanmin Guo, 21 Sep 2011, In: Journal of Chemical Physics. 135, 11, p. 114702 1 p.

    Research output: Contribution to journalArticle

  35. Published
  36. Published
  37. 2010
  38. Published

    Cold chemistry with electronically excited Ca+ Coulomb crystals

    Tim Softley, 1 Nov 2010, In: Journal of Chemical Physics. 133, ARTN 194302

    Research output: Contribution to journalArticlepeer-review

  39. 2009
  40. Published
  41. Published

    A model Hamiltonian to simulate the complex photochemistry of benzene II

    Graham Worth, 1 Aug 2009, In: Journal of Chemical Physics. 131, 6, p. 064303 1 p.

    Research output: Contribution to journalArticle

  42. Published

    Vacuum-UV negative photoion spectroscopy of CF3Cl, CF3Br, and CF3I

    Richard Tuckett, 21 May 2009, In: Journal of Chemical Physics. 130, 19, p. 194302-1 - 194302-11

    Research output: Contribution to journalArticlepeer-review

  43. Published

    The self-assembly of DNA Holliday junctions studied with a minimal model

    Iain Johnston, 14 Feb 2009, In: Journal of Chemical Physics. 130, 6, p. 065101

    Research output: Contribution to journalArticlepeer-review

  44. 2008
  45. Published
  46. Published

    Vacuum-UV negative photoion spectroscopy of SF5CF3

    Richard Tuckett, 28 Mar 2008, In: Journal of Chemical Physics. 128, 12, p. 124315-1 - 124315-10

    Research output: Contribution to journalArticlepeer-review

  47. Published
  48. Published

    Structural motifs, mixing, and segregation effects in 38-atom binary clusters

    Roy Johnston, 1 Jan 2008, In: Journal of Chemical Physics. 128, 13, p. 134517 1 p.

    Research output: Contribution to journalArticle

  49. 2007
  50. Published

    Ionization of H2 Rydberg molecules at a metal surface.

    Tim Softley, 1 May 2007, In: Journal of Chemical Physics. 126, p. 184702 1 p.

    Research output: Contribution to journalArticlepeer-review

  51. 2006
  52. Published
  53. Published

    Analyzing energy landscapes for folding model proteins

    Roy Johnston, 1 Jan 2006, In: Journal of Chemical Physics. 124, 20, p. 204714 1 p.

    Research output: Contribution to journalArticle

  54. Published

    Infrared spectroscopy ofLi(NH3)x clusters

    Victor Mikhailov, 1 Jan 2006, In: Journal of Chemical Physics. 125, 3, p. art. no. 034302

    Research output: Contribution to journalArticle

  55. Published

    Pinning of size-selected Pd nanoclusters on graphite

    Marcel Di Vece & Richard Palmer, 1 Jan 2006, In: Journal of Chemical Physics. 125, p. 084704 1 p.

    Research output: Contribution to journalArticle

  56. 2005
  57. Published
  58. Published
  59. Published

    Velocity-map imaging study of the photodissociation of acetaldehyde.

    Tim Softley, 1 Mar 2005, In: Journal of Chemical Physics. 122, p. 124303 1 p.

    Research output: Contribution to journalArticlepeer-review

  60. Published
  61. Published
  62. Published
  63. Published
  64. Published
  65. Published
  66. Published
  67. 2004
  68. Published

    Demonstration of the combination of slice imaging and Rydberg tagging for studies of photodissociation dynamics.

    Tim Softley, 1 Sep 2004, In: Journal of Chemical Physics. 121, p. 4089-4096 8 p.

    Research output: Contribution to journalArticlepeer-review

  69. Published

    Deflection and deceleration of hydrogen Rydberg molecules in inhomogeneous electric fields.

    Tim Softley, 1 Jul 2004, In: Journal of Chemical Physics. 121, p. 1419-1431 13 p.

    Research output: Contribution to journalArticlepeer-review

  70. Published

    Above the surface multifragmentation of surface scattered fullerenes

    Andre Kaplan, 1 Jun 2004, In: Journal of Chemical Physics. 120(23), p. 11026-11030 5 p.

    Research output: Contribution to journalArticle

  71. Published
  72. Published

    Physisorption of molecular oxygen on C₆₀ thin film

    Zi Li, 1 Jan 2004, In: Journal of Chemical Physics. 120, p. 10225 1 p.

    Research output: Contribution to journalArticle

  73. Published
  74. Published
  75. 2003
  76. Published

    The role of phase in molecular Rydberg wave packet dynamics

    Tim Softley, 1 Aug 2003, In: Journal of Chemical Physics. 119, p. 3085-3091 7 p.

    Research output: Contribution to journalArticlepeer-review

  77. Published

    High-resolution threshold-ionization spectroscopy of NH3

    Tim Softley, 1 Jun 2003, In: Journal of Chemical Physics. 118, p. 10024-10033 10 p.

    Research output: Contribution to journalArticlepeer-review

  78. Published
  79. Published

    Mixed quantum-classical Liouville molecular dynamics without momentum jump

    Koji Ando, 1 Jan 2003, In: Journal of Chemical Physics. 118, 23, p. 10399-10406 8 p.

    Research output: Contribution to journalArticle

  80. Published

    Path Integral Monte Carlo Calculation of Reaction-Diffusion Equation

    Koji Ando, 1 Jan 2003, In: Journal of Chemical Physics. 118, 18, p. 8315-8320 6 p.

    Research output: Contribution to journalArticle

  81. 2002
  82. Published
  83. Published
  84. Published

    The Stark effect in the v(+)=1 autoionizing Rydberg states of NO

    Tim Softley, 1 Mar 2002, In: Journal of Chemical Physics. 116, p. 4922-4937 16 p.

    Research output: Contribution to journalArticlepeer-review

  85. Published

    Amorphous structures of Cu, Ag and Au nanoclusters from first principles calculations

    Richard Palmer, 1 Jan 2002, In: Journal of Chemical Physics. 117, 21, p. 9548-9551 4 p.

    Research output: Contribution to journalArticle

  86. Published
  87. Published

    Global optimization analysis of water clusters (H₂O)n (11≤n≤13) through a genetic algorithm

    Roy Johnston, 1 Jan 2002, In: Journal of Chemical Physics. 116, 19, p. 8327-8333 7 p.

    Research output: Contribution to journalArticle

  88. Published
  89. Published

    Theoretical study of Cu-Au Nanoalloy clusters using a genetic algorithm

    Roy Johnston, 1 Jan 2002, In: Journal of Chemical Physics. 116, 4, p. 1536-1550 15 p.

    Research output: Contribution to journalArticlepeer-review

  90. Published

    Vacuum ultraviolet surface photochemistry of water adsorbed on graphite

    Damien Riedel, Quanmin Guo & Richard Palmer, 1 Jan 2002, In: Journal of Chemical Physics. 117, 14, p. 6667-6672 6 p.

    Research output: Contribution to journalArticle

  91. 2001
  92. Published

    Spatial discrimination of Rydberg tagged molecular photofragments in an inhomogeneous electric field

    Tim Softley, 1 Nov 2001, In: Journal of Chemical Physics. 115, p. 7924-7934 11 p.

    Research output: Contribution to journalArticlepeer-review

  93. Published

    Vacuum-Ultraviolet absorption and fluorescence spectroscopy of CF2H2, CF2Cl2 and CF2Br2 in the range 8-22 eV

    Richard Tuckett, 1 Mar 2001, In: Journal of Chemical Physics. 114, 9, p. 4058-4073 16 p.

    Research output: Contribution to journalArticlepeer-review

  94. E-pub ahead of print
  95. Published
  96. Published
  97. Published
  98. Published
  99. Published

    Far-infrared laser VRT spectroscopy of water clusters in the liberational brand region of liquid water

    Mark Viant, 1 Jan 2001, In: Journal of Chemical Physics. 114, p. 4005-4015 11 p.

    Research output: Contribution to journalArticle

  100. Published
  101. Published
  102. Published
  103. Published
  104. Published

    The Poisson equation in density fitting for the Kohn-Sham Coulomb problem

    Frederick Manby, Peter Knowles, 1 Jan 2001, In: Journal of Chemical Physics. 115, 20, p. 9144-9148 5 p.

    Research output: Contribution to journalArticle

  105. 2000
  106. Published

    Rydberg state decay in inhomogeneous electric fields

    Tim Softley, 1 May 2000, In: Journal of Chemical Physics. 112, p. 7992-8005 14 p.

    Research output: Contribution to journalArticlepeer-review

  107. Published

    Investigation of geometric shell aluminum clusters using the Gupta many-body potential

    Roy Johnston & Nicholas Wilson, 8 Mar 2000, In: Journal of Chemical Physics. 112, 10, p. 4773-4778 6 p.

    Research output: Contribution to journalArticlepeer-review

  108. Published

    Rapidly fluctuating anisotropy parameter in the near-threshold photodissociation of NO2

    Tim Softley, 1 Feb 2000, In: Journal of Chemical Physics. 112, p. 3699-3709 11 p.

    Research output: Contribution to journalArticlepeer-review

  109. 1998
  110. Published

    Vacuum-UV fluorescence spectroscopy of PF3 in the range 9–20 eV

    Richard Tuckett, 15 Jan 1998, In: Journal of Chemical Physics. 108, 3, p. 857-868

    Research output: Contribution to journalArticlepeer-review

  111. 1997
  112. Published

    Modeling calcium and strontium clusters with many-body potentials

    Roy Johnston, 22 Sep 1997, In: Journal of Chemical Physics. 107, 12, p. 4674-4687 14 p.

    Research output: Contribution to journalArticlepeer-review

  113. Published

    Vacuum-UV fluorescence spectroscopy of SiF4SiF4 in the range 10–30 eV

    Richard Tuckett, 15 Jul 1997, In: Journal of Chemical Physics. 107, 3, p. 720-729

    Research output: Contribution to journalArticlepeer-review

  114. Published
  115. 1995
  116. Published

    Rotational autoionization dynamics in high Rydberg states of nitrogen

    Tim Softley, 1 Dec 1995, In: Journal of Chemical Physics. 103, p. 4509-4518 10 p.

    Research output: Contribution to journalArticlepeer-review

  117. Published
  118. 1994
  119. Published
  120. Published

    New experimental method for studying rotationally state‐selected ion‐molecule reactions

    Tim Softley, 1 Dec 1994, In: Journal of Chemical Physics. 101, p. 10609-10617 9 p.

    Research output: Contribution to journalArticlepeer-review

  121. Published

    MULTICHANNEL QUANTUM-DEFECT THEORY SIMULATION OF THE ZERO-KINETIC-ENERGY PHOTOELECTRON-SPECTRUM OF H-2

    Tim Softley, 1 Jul 1994, In: Journal of Chemical Physics. 101, p. 923-928 6 p.

    Research output: Contribution to journalArticlepeer-review

  122. 1993
  123. Published

    Preparation of ions in selected rotational states by delayed pulsed field ionization

    Tim Softley, 1 Dec 1993, In: Journal of Chemical Physics. 99, p. 4213-4214 2 p.

    Research output: Contribution to journalArticlepeer-review

  124. Published

    Zero-kinetic-energy photoelectron spectrum of carbon dioxide

    Tim Softley, 1 Dec 1993, In: Journal of Chemical Physics. 99, p. 8430-8439 10 p.

    Research output: Contribution to journalArticlepeer-review

  125. Published

    Vibrational state specificity and selectivity in the reactions N+OH→NO(v)+H and N+NO(v)→N2+O

    Ian Smith, Richard Tuckett, 15 Apr 1993, In: Journal of Chemical Physics. 98, 8, p. 6267-6275

    Research output: Contribution to journalArticlepeer-review

  126. 1992
  127. Published

    FINAL-STATE INTERACTIONS IN THE ZERO-KINETIC-ENERGY-PHOTOELECTRON SPECTRUM OF H-2

    Tim Softley, 1 Mar 1992, In: Journal of Chemical Physics. 96, p. 4149-4156 8 p.

    Research output: Contribution to journalArticlepeer-review

  128. 1990
  129. Published
  130. Published
  131. Published
  132. Published

    STATE SELECTIVE DOUBLY ENHANCED SUM-FREQUENCY MIXING IN CO

    Tim Softley, 1 Aug 1990, In: Journal of Chemical Physics. 93, p. 1540-1545 6 p.

    Research output: Contribution to journalArticlepeer-review

  133. 1988
  134. Published
  135. Published

    Electronic emission spectroscopy of Group IV tetrachloro molecular ions

    Richard Tuckett, 1 Sep 1988, In: Journal of Chemical Physics. 89, 5, p. 2675-2682

    Research output: Contribution to journalArticlepeer-review