| Year |
Citation |
Score |
| 2020 |
Abbott HE, Hey JC, Britton MM, Johnston RL. Effects of Hydration on the Conformational Behavior of Flexible Molecules with Two Charge Centers. The Journal of Physical Chemistry. A. PMID 32501011 DOI: 10.1021/Acs.Jpca.0C02004 |
0.312 |
|
| 2020 |
Rao AB, Shaw J, Neophytou A, Morphew D, Sciortino F, Johnston RL, Chakrabarti D. Leveraging Hierarchical Self-Assembly Pathways for Realizing Colloidal Photonic Crystals. Acs Nano. PMID 32374160 DOI: 10.1021/Acsnano.9B07849 |
0.307 |
|
| 2020 |
Li L, Huang R, Wen Y, Johnston RL. Structural and magnetic properties of Co-Pt clusters: A spin-polarized density functional study Journal of Magnetism and Magnetic Materials. 503: 166651. DOI: 10.1016/J.Jmmm.2020.166651 |
0.394 |
|
| 2019 |
Abdulhussein HA, Ferrari P, Vanbuel J, Heard C, Fielicke A, Lievens P, Janssens E, Johnston RL. Altering CO binding on gold cluster cations by Pd-doping. Nanoscale. PMID 31432842 DOI: 10.1039/C9Nr04237G |
0.383 |
|
| 2019 |
Gleditzsch M, Pašteka LF, Götz DA, Shayeghi A, Johnston RL, Schäfer R. Gold doping of tin clusters: exo- vs. endohedral complexes. Nanoscale. PMID 31243419 DOI: 10.1039/C9Nr03233A |
0.41 |
|
| 2019 |
Wang J, Chen F, Jin Y, Guo L, Gong X, Wang X, Johnston RL. In situ high-potential-driven surface restructuring of ternary AgPd-Pt aerogels with record-high performance improvement for formate oxidation electrocatalysis. Nanoscale. PMID 31210227 DOI: 10.1039/C9Nr03266E |
0.331 |
|
| 2019 |
Jäger M, Schäfer R, Johnston RL. GIGA: a versatile genetic algorithm for free and supported clusters and nanoparticles in the presence of ligands. Nanoscale. PMID 31025685 DOI: 10.1039/C9Nr02031D |
0.395 |
|
| 2019 |
Hussein HA, Gao M, Hou Y, Horswell SL, Johnston RL. Physico-Chemical Insights into Gas-Phase and Oxide-Supported Sub-Nanometre AuCu Clusters Zeitschrift FüR Physikalische Chemie. 233: 813-843. DOI: 10.1515/Zpch-2018-1356 |
0.409 |
|
| 2019 |
Granja-DelRío A, Abdulhussein HA, Johnston RL. DFT-Based Global Optimization of Sub-nanometer Ni–Pd Clusters The Journal of Physical Chemistry C. 123: 26583-26596. DOI: 10.1021/Acs.Jpcc.9B05970 |
0.412 |
|
| 2018 |
Jäger M, Shayeghi A, Klippenstein V, Johnston RL, Schäfer R. Chemical bonding in initial building blocks of semiconductors: Geometrical structures and optical absorption spectra of isolated and Cd species. The Journal of Chemical Physics. 149: 244308. PMID 30599714 DOI: 10.1063/1.5066414 |
0.354 |
|
| 2018 |
Demiroglu I, Fan TE, Li ZY, Yuan J, Liu TD, Piccolo L, Johnston RL. Modelling free and oxide-supported nanoalloy catalysts: comparison of bulk-immiscible Pd-Ir and Au-Rh systems and influence of a TiO support. Faraday Discussions. PMID 29796531 DOI: 10.1039/C7Fd00213K |
0.302 |
|
| 2018 |
Hey JC, Doyle EJ, Chen Y, Johnston RL. Isomers and energy landscapes of micro-hydrated sulfite and chlorate clusters. Philosophical Transactions. Series a, Mathematical, Physical, and Engineering Sciences. 376. PMID 29431682 DOI: 10.1098/Rsta.2017.0154 |
0.402 |
|
| 2018 |
Aslan M, Johnston RL. Pentameric PdAu and PdPt nanoparticles on the MgO(1 0 0) surface and their CO and O2 adsorption properties The European Physical Journal B. 91. DOI: 10.1140/Epjb/E2018-90060-6 |
0.403 |
|
| 2018 |
Guerrero-Jordan J, Cabellos JL, Johnston RL, Posada-Amarillas A. Theoretical investigation of the structures of unsupported 38-atom CuPt clusters The European Physical Journal B. 91. DOI: 10.1140/Epjb/E2018-90020-2 |
0.444 |
|
| 2018 |
Aslan M, Johnston RL. Anionic cobalt-platinum-ethynyl (CoPt–C2H) metal-organic subnanoparticles: a DFT modeling study The European Physical Journal B. 91. DOI: 10.1140/Epjb/E2018-90004-2 |
0.397 |
|
| 2018 |
Hussein HA, Demiroglu I, Johnston RL. Application of a parallel genetic algorithm to the global optimization of medium-sized Au–Pd sub-nanometre clusters The European Physical Journal B. 91. DOI: 10.1140/Epjb/E2017-80314-2 |
0.434 |
|
| 2018 |
Ferrari P, Hussein HA, Heard CJ, Vanbuel J, Johnston RL, Lievens P, Janssens E. Effect of palladium doping on the stability and fragmentation patterns of cationic gold clusters Physical Review A. 97. DOI: 10.1103/Physreva.97.052508 |
0.342 |
|
| 2017 |
Fan TE, Demiroglu I, Hussein HA, Liu TD, Johnston RL. DFT study of the structure, chemical ordering and molecular adsorption of Pd-Ir nanoalloys. Physical Chemistry Chemical Physics : Pccp. PMID 28960217 DOI: 10.1039/C7Cp04811D |
0.319 |
|
| 2017 |
Demiroglu I, Yao K, Hussein HA, Johnston RL. DFT Global Optimization of Gas-Phase Subnanometer Ru–Pt Clusters The Journal of Physical Chemistry C. 121: 10773-10780. DOI: 10.1021/Acs.Jpcc.6B11329 |
0.409 |
|
| 2017 |
Buendía F, Vargas JA, Johnston RL, Beltrán MR. Study of the stability of small AuRh clusters found by a Genetic Algorithm methodology Computational and Theoretical Chemistry. 1119: 51-58. DOI: 10.1016/J.Comptc.2017.09.008 |
0.448 |
|
| 2017 |
Demiroglu I, Li Z, Piccolo L, Johnston RL. A DFT study of molecular adsorption on titania-supported AuRh nanoalloys Computational and Theoretical Chemistry. 1107: 142-151. DOI: 10.1016/J.Comptc.2017.02.012 |
0.39 |
|
| 2017 |
Yu H, Cao D, Fisher A, Johnston RL, Cheng D. Size effect on the adsorption and dissociation of CO2 on Co nanoclusters Applied Surface Science. 396: 539-546. DOI: 10.1016/J.Apsusc.2016.10.192 |
0.305 |
|
| 2017 |
Wang J, Chen F, Jin Y, Lei Y, Johnston RL. One-Pot Synthesis of Dealloyed AuNi Nanodendrite as a Bifunctional Electrocatalyst for Oxygen Reduction and Borohydride Oxidation Reaction Advanced Functional Materials. 27: 1700260. DOI: 10.1002/Adfm.201700260 |
0.304 |
|
| 2016 |
Piccolo L, Li ZY, Demiroglu I, Moyon F, Konuspayeva Z, Berhault G, Afanasiev P, Lefebvre W, Yuan J, Johnston RL. Understanding and controlling the structure and segregation behaviour of AuRh nanocatalysts. Scientific Reports. 6: 35226. PMID 27739480 DOI: 10.1038/Srep35226 |
0.394 |
|
| 2016 |
Hussein HA, Davis JB, Johnston RL. DFT global optimisation of gas-phase and MgO-supported sub-nanometre AuPd clusters. Physical Chemistry Chemical Physics : Pccp. 18: 26133-26143. PMID 27711424 DOI: 10.1039/C6Cp03958H |
0.407 |
|
| 2016 |
Buendía F, Vargas JA, Beltrán MR, Davis JB, Johnston RL. A comparative study of AumRhn (4 ≤ m + n ≤ 6) clusters in the gas phase versus those deposited on (100) MgO. Physical Chemistry Chemical Physics : Pccp. PMID 27444254 DOI: 10.1039/C6Cp03735F |
0.399 |
|
| 2016 |
Hey JC, Smeeton LC, Oakley MT, Johnston RL. Conformations and Energy Landscapes of Perchlorate-Water Clusters and a Comparison to Pure Water and Sulfate-Water Clusters. The Journal of Physical Chemistry. A. PMID 27223243 DOI: 10.1021/Acs.Jpca.6B01495 |
0.334 |
|
| 2016 |
Götz DA, Shayeghi A, Johnston RL, Schwerdtfeger P, Schäfer R. Structural evolution and metallicity of lead clusters. Nanoscale. PMID 27181365 DOI: 10.1039/C6Nr02080A |
0.411 |
|
| 2016 |
Aslan M, Davis JB, Johnston RL. Global optimization of small bimetallic Pd-Co binary nanoalloy clusters: a genetic algorithm approach at the DFT level. Physical Chemistry Chemical Physics : Pccp. PMID 26872088 DOI: 10.1039/C6Cp00342G |
0.384 |
|
| 2016 |
Heard C, Shayeghi A, Schäfer R, Johnston R. Charge and compositional effects on the 2D-3D transition in octameric AgAu clusters Zeitschrift Fur Physikalische Chemie. 230: 955-975. DOI: 10.1515/Zpch-2015-0721 |
0.401 |
|
| 2016 |
Demiroglu I, Li ZY, Piccolo L, Johnston RL. A DFT study of molecular adsorption on Au–Rh nanoalloys Catalysis Science & Technology. 6: 6916-6931. DOI: 10.1039/C6Cy01107A |
0.304 |
|
| 2016 |
Davis JBA, Horswell SL, Johnston RL. Application of a Parallel Genetic Algorithm to the Global Optimization of Gas-Phase and Supported Gold-Iridium Sub-Nanoalloys Journal of Physical Chemistry C. 120: 3759-3765. DOI: 10.1021/Acs.Jpcc.5B10226 |
0.392 |
|
| 2016 |
Kaydashev V, Ferrari P, Heard C, Janssens E, Johnston RL, Lievens P. Optical Absorption of Small Palladium-Doped Gold Clusters Particle and Particle Systems Characterization. DOI: 10.1002/Ppsc.201600036 |
0.359 |
|
| 2015 |
Smeeton LC, Farrell JD, Oakley MT, Wales DJ, Johnston RL. Structures and Energy Landscapes of Hydrated Sulfate Clusters. Journal of Chemical Theory and Computation. 11: 2377-84. PMID 26574432 DOI: 10.1021/Acs.Jctc.5B00151 |
0.396 |
|
| 2015 |
Davis JB, Baletto F, Johnston RL. The Effect of Dispersion Correction on the Adsorption of CO on Metallic Nanoparticles. The Journal of Physical Chemistry. A. 119: 9703-9. PMID 26320360 DOI: 10.1021/Acs.Jpca.5B05710 |
0.336 |
|
| 2015 |
Davis JB, Shayeghi A, Horswell SL, Johnston RL. The Birmingham parallel genetic algorithm and its application to the direct DFT global optimisation of Ir(N) (N = 10-20) clusters. Nanoscale. 7: 14032-8. PMID 26239404 DOI: 10.1039/C5Nr03774C |
0.394 |
|
| 2015 |
Shayeghi A, Johnston RL, Rayner DM, Schäfer R, Fielicke A. The Nature of Bonding between Argon and Mixed Gold-Silver Trimers. Angewandte Chemie (International Ed. in English). 54: 10675-80. PMID 26206667 DOI: 10.1002/Anie.201503845 |
0.328 |
|
| 2015 |
Shayeghi A, Schäfer R, Rayner DM, Johnston RL, Fielicke A. Charge-induced dipole vs. relativistically enhanced covalent interactions in Ar-tagged Au-Ag tetramers and pentamers. The Journal of Chemical Physics. 143: 024310. PMID 26178108 DOI: 10.1063/1.4923255 |
0.384 |
|
| 2015 |
Arslan H, Garip AK, Johnston RL. Theoretical study of the structures and chemical ordering of cobalt-palladium nanoclusters. Physical Chemistry Chemical Physics : Pccp. PMID 25960076 DOI: 10.1039/C5Cp01029B |
0.426 |
|
| 2015 |
Heard CJ, Johnston RL, Schön JC. Energy landscape exploration of sub-nanometre copper-silver clusters. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 16: 1461-9. PMID 25784077 DOI: 10.1002/Cphc.201402887 |
0.436 |
|
| 2015 |
Shayeghi A, Götz D, Davis JB, Schäfer R, Johnston RL. Pool-BCGA: a parallelised generation-free genetic algorithm for the ab initio global optimisation of nanoalloy clusters. Physical Chemistry Chemical Physics : Pccp. 17: 2104-12. PMID 25482360 DOI: 10.1039/C4Cp04323E |
0.395 |
|
| 2015 |
Shayeghi A, Götz DA, Johnston RL, Schäfer R. Optical absorption spectra and structures of Ag 6+ and Ag8+ European Physical Journal D. 69. DOI: 10.1140/Epjd/E2015-60188-2 |
0.37 |
|
| 2014 |
Davis JB, Johnston RL, Rubinovich L, Polak M. Comparative modelling of chemical ordering in palladium-iridium nanoalloys. The Journal of Chemical Physics. 141: 224307. PMID 25494749 DOI: 10.1063/1.4903188 |
0.395 |
|
| 2014 |
Shayeghi A, Johnston RL, Schäfer R. Communication: Global minimum search of Ag₁₀⁺ with molecular beam optical spectroscopy. The Journal of Chemical Physics. 141: 181104. PMID 25399125 DOI: 10.1063/1.4901109 |
0.371 |
|
| 2014 |
Aveyard R, Ferrando R, Johnston RL, Yuan J. Modeling nanoscale inhomogeneities for quantitative HAADF STEM imaging. Physical Review Letters. 113: 075501. PMID 25170712 DOI: 10.1103/Physrevlett.113.075501 |
0.325 |
|
| 2014 |
Heard CJ, Heiles S, Vajda S, Johnston RL. Pd(n)Ag(4-n) and Pd(n)Pt(4-n) clusters on MgO (100): a density functional surface genetic algorithm investigation. Nanoscale. 6: 11777-88. PMID 25158024 DOI: 10.1039/C4Nr03363A |
0.402 |
|
| 2014 |
Atanasov I, Ferrando R, Johnston RL. Structure and solid solution properties of Cu-Ag nanoalloys. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 26: 275301. PMID 24918748 DOI: 10.1088/0953-8984/26/27/275301 |
0.385 |
|
| 2014 |
Götz DA, Shayeghi A, Johnston RL, Schwerdtfeger P, Schäfer R. Influence of spin-orbit effects on structures and dielectric properties of neutral lead clusters. The Journal of Chemical Physics. 140: 164313. PMID 24784276 DOI: 10.1063/1.4872369 |
0.412 |
|
| 2014 |
Heard CJ, Johnston RL. A theoretical study of the structures and optical spectra of helical copper-silver clusters. Physical Chemistry Chemical Physics : Pccp. 16: 21039-48. PMID 24618922 DOI: 10.1039/C3Cp55507K |
0.413 |
|
| 2014 |
Shayeghi A, Heard CJ, Johnston RL, Schäfer R. Optical and electronic properties of mixed Ag-Au tetramer cations. The Journal of Chemical Physics. 140: 054312. PMID 24511945 DOI: 10.1063/1.4863443 |
0.398 |
|
| 2014 |
Davis JB, Horswell SL, Johnston RL. Global optimization of 8-10 atom palladium-iridium nanoalloys at the DFT level. The Journal of Physical Chemistry. A. 118: 208-14. PMID 24328270 DOI: 10.1021/Jp408519Z |
0.386 |
|
| 2014 |
Jennings PC, Aleksandrov HA, Neyman KM, Johnston RL. A DFT study of oxygen dissociation on platinum based nanoparticles. Nanoscale. 6: 1153-1165. PMID 24296728 DOI: 10.1039/C3Nr04750D |
0.358 |
|
| 2014 |
Bruma A, Negreiros FR, Xie S, Tsukuda T, Johnston RL, Fortunelli A, Li ZY. Direct atomic imaging and density functional theory study of the Au24Pd1 cluster catalyst. Nanoscale. 5: 9620-5. PMID 23764617 DOI: 10.1039/C3Nr01852K |
0.423 |
|
| 2014 |
Heard CJ, Vajda S, Johnston RL. Support and Oxidation Effects on Subnanometer Palladium Nanoparticles Journal of Physical Chemistry C. 118: 3581-3589. DOI: 10.1021/Jp411019T |
0.425 |
|
| 2013 |
Borbón-González DJ, Fortunelli A, Barcaro G, Sementa L, Johnston RL, Posada-Amarillas A. Global minimum Pt(13)M(20) (M = Ag, Au, Cu, Pd) dodecahedral core-shell clusters. The Journal of Physical Chemistry. A. 117: 14261-6. PMID 24303915 DOI: 10.1021/Jp410079T |
0.403 |
|
| 2013 |
Shayeghi A, Johnston RL, Schäfer R. Evaluation of photodissociation spectroscopy as a structure elucidation tool for isolated clusters: a case study of Ag4(+) and Au4(+). Physical Chemistry Chemical Physics : Pccp. 15: 19715-23. PMID 24136716 DOI: 10.1039/C3Cp52160E |
0.432 |
|
| 2013 |
Chantry RL, Atanasov I, Siriwatcharapiboon W, Khanal BP, Zubarev ER, Horswell SL, Johnston RL, Li ZY. An atomistic view of the interfacial structures of AuRh and AuPd nanorods. Nanoscale. 5: 7452-7. PMID 23832276 DOI: 10.1039/C3Nr02560H |
0.352 |
|
| 2013 |
Kwon G, Ferguson GA, Heard CJ, Tyo EC, Yin C, DeBartolo J, Seifert S, Winans RE, Kropf AJ, Greeley J, Johnston RL, Curtiss LA, Pellin MJ, Vajda S. Size-dependent subnanometer Pd cluster (Pd4, Pd6, and Pd17) water oxidation electrocatalysis. Acs Nano. 7: 5808-17. PMID 23799858 DOI: 10.1021/Nn400772S |
0.311 |
|
| 2013 |
Atanasov I, Barcaro G, Negreiros FR, Fortunelli A, Johnston RL. Modelling the metal-on-top effect for Pd clusters on the MgO{100} substrate. The Journal of Chemical Physics. 138: 224703. PMID 23781811 DOI: 10.1063/1.4807725 |
0.364 |
|
| 2013 |
Logsdail AJ, Li ZY, Johnston RL. Faceting preferences for Au(N) and Pd(N) nanoclusters with high-symmetry motifs. Physical Chemistry Chemical Physics : Pccp. 15: 8392-400. PMID 23624747 DOI: 10.1039/C3Cp50978H |
0.676 |
|
| 2013 |
Fennell J, He D, Tanyi AM, Logsdail AJ, Johnston RL, Li ZY, Horswell SL. A selective blocking method to control the overgrowth of Pt on Au nanorods. Journal of the American Chemical Society. 135: 6554-61. PMID 23594230 DOI: 10.1021/Ja4003475 |
0.633 |
|
| 2013 |
Oakley MT, Johnston RL, Wales DJ. Symmetrisation schemes for global optimisation of atomic clusters. Physical Chemistry Chemical Physics : Pccp. 15: 3965-76. PMID 23389762 DOI: 10.1039/C3Cp44332A |
0.43 |
|
| 2013 |
Bruma A, Ismail R, Paz-Borbón LO, Arslan H, Barcaro G, Fortunelli A, Li ZY, Johnston RL. DFT study of the structures and energetics of 98-atom AuPd clusters. Nanoscale. 5: 646-52. PMID 23223667 DOI: 10.1039/C2Nr32517A |
0.437 |
|
| 2013 |
West PS, Johnston RL, Barcaro G, Fortunelli A. Effect of CO and H adsorption on the compositional structure of binary nanoalloys via DFT modeling The European Physical Journal D. 67. DOI: 10.1140/Epjd/E2013-40257-4 |
0.385 |
|
| 2013 |
Heard CJ, Johnston RL. A density functional global optimisation study of neutral 8-atom Cu-Ag and Cu-Au clusters The European Physical Journal D. 67. DOI: 10.1140/Epjd/E2012-30601-7 |
0.424 |
|
| 2013 |
Pacheco-Contreras R, Borbón-González DJ, Dessens-Félix M, Paz-Borbón LO, Johnston RL, Schön JC, Jansen M, Posada-Amarillas A. Determination of the energy landscape of Pd12Pt1 using a combined genetic algorithm and threshold energy method Rsc Advances. 3: 11571. DOI: 10.1039/C3Ra41477A |
0.407 |
|
| 2013 |
Logsdail AJ, Johnston RL, Akola J. Improving the Adsorption of Au Atoms and Nanoparticles on Graphite via Li Intercalation The Journal of Physical Chemistry C. 117: 22683-22695. DOI: 10.1021/Jp405670V |
0.677 |
|
| 2013 |
Jennings PC, Johnston RL. Structures of small Ti- and V-doped Pt clusters: A GA-DFT study Computational and Theoretical Chemistry. 1021: 91-100. DOI: 10.1016/J.Comptc.2013.06.033 |
0.36 |
|
| 2013 |
Heiles S, Johnston RL. Global optimization of clusters using electronic structure methods International Journal of Quantum Chemistry. 113: 2091-2109. DOI: 10.1002/Qua.24462 |
0.441 |
|
| 2012 |
Heiles S, Johnston RL, Schäfer R. Bismuth-doped tin clusters: experimental and theoretical studies of neutral Zintl analogues. The Journal of Physical Chemistry. A. 116: 7756-64. PMID 22709275 DOI: 10.1021/Jp304321U |
0.434 |
|
| 2012 |
Götz DA, Heiles S, Johnston RL, Schäfer R. Note: gas phase structures of bare Si8 and Si11 clusters from molecular beam electric deflection experiments. Journal of Chemical Physics. 136: 186101-186101. PMID 22583313 DOI: 10.1063/1.4717708 |
0.304 |
|
| 2012 |
Chantry RL, Siriwatcharapiboon W, Horswell SL, Logsdail AJ, Johnston RL, Li ZY. Overgrowth of Rhodium on Gold Nanorods. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 116: 10312-10317. PMID 22582111 DOI: 10.1021/Jp212432G |
0.644 |
|
| 2012 |
Pacheco-Contreras R, Dessens-Félix M, Borbón-González DJ, Paz-Borbón LO, Johnston RL, Schön JC, Posada-Amarillas A. Tetrahelix conformations and transformation pathways in Pt1Pd12 clusters. The Journal of Physical Chemistry. A. 116: 5235-9. PMID 22559786 DOI: 10.1021/Jp3023925 |
0.418 |
|
| 2012 |
Jennings PC, Pollet BG, Johnston RL. Theoretical studies of Pt-Ti nanoparticles for potential use as PEMFC electrocatalysts. Physical Chemistry Chemical Physics : Pccp. 14: 3134-9. PMID 22282058 DOI: 10.1039/C2Cp23430K |
0.384 |
|
| 2012 |
Tran DT, Jones IP, Preece JA, Johnston RL, Deplanche K, Macaskie LE. Configuration of microbially synthesized Pd-Au nanoparticles studied by STEM-based techniques. Nanotechnology. 23: 055701. PMID 22236722 DOI: 10.1088/0957-4484/23/5/055701 |
0.326 |
|
| 2012 |
Logsdail AJ, Li ZY, Johnston RL. Development and optimization of a novel genetic algorithm for identifying nanoclusters from scanning transmission electron microscopy images. Journal of Computational Chemistry. 33: 391-400. PMID 22120989 DOI: 10.1002/Jcc.21976 |
0.678 |
|
| 2012 |
Heiles S, Logsdail AJ, Schäfer R, Johnston RL. Dopant-induced 2D-3D transition in small Au-containing clusters: DFT-global optimisation of 8-atom Au-Ag nanoalloys. Nanoscale. 4: 1109-15. PMID 22012270 DOI: 10.1039/C1Nr11053E |
0.706 |
|
| 2012 |
Oakley MT, Wales DJ, Johnston RL. The Effect of Nonnative Interactions on the Energy Landscapes of Frustrated Model Proteins Journal of Atomic, Molecular, and Optical Physics. 2012: 1-9. DOI: 10.1155/2012/192613 |
0.304 |
|
| 2012 |
Logsdail AJ, Johnston RL. Interdependence of structure and chemical order in high symmetry (PdAu)N nanoclusters Rsc Advances. 2: 5863. DOI: 10.1039/C2Ra20309J |
0.677 |
|
| 2012 |
Ismail R, Ferrando R, Johnston RL. Theoretical Study of the Structures and Chemical Ordering of Palladium–Gold Nanoalloys Supported on MgO(100) The Journal of Physical Chemistry C. 117: 293-301. DOI: 10.1021/Jp3093435 |
0.427 |
|
| 2012 |
Logsdail AJ, Johnston RL. Predicting the Optical Properties of Core–Shell and Janus Segregated Au–M Nanoparticles (M = Ag, Pd) The Journal of Physical Chemistry C. 116: 23616-23628. DOI: 10.1021/Jp306000U |
0.641 |
|
| 2012 |
Jennings PC, Pollet BG, Johnston RL. Electronic Properties of Pt–Ti Nanoalloys and the Effect on Reactivity for Use in PEMFCs The Journal of Physical Chemistry C. 116: 15241-15250. DOI: 10.1021/Jp303577T |
0.372 |
|
| 2012 |
He D, Logsdail A, Johnston R, Palmer R, Yin F, Li Z, Aveyard R, Yuan J. Atomic Cluster Structure Identification Using Aberration-corrected Scanning Transmission Electron Microscopy Microscopy and Microanalysis. 18: 534-535. DOI: 10.1017/S1431927612004527 |
0.685 |
|
| 2012 |
Heiles S, Hofmann K, Johnston RL, Schäfer R. Nine-Atom Tin-Bismuth Clusters: Mimicking Excess Electrons by Element Substitution Chempluschem. 77: 532-535. DOI: 10.1002/Cplu.201200085 |
0.362 |
|
| 2011 |
Tran DT, Johnston RL. Study of 40-atom Pt-Au clusters using a combined empirical potential-density functional approach Proceedings of the Royal Society a: Mathematical, Physical and Engineering Sciences. 467: 2004-2019. DOI: 10.1098/Rspa.2010.0562 |
0.463 |
|
| 2011 |
Chen F, Li ZY, Johnston RL. Surface reconstruction precursor to melting in Au309 clusters Aip Advances. 1: 032105. DOI: 10.1063/1.3613650 |
0.365 |
|
| 2011 |
Tran DT, Jones IP, Preece JA, Johnston RL, Van Den Brom CR. TEM characterization of chemically synthesized copper-gold nanoparticles Journal of Nanoparticle Research. 13: 4229-4237. DOI: 10.1007/S11051-011-0367-2 |
0.326 |
|
| 2010 |
Ismail R, Johnston RL. Investigation of the structures and chemical ordering of small Pd-Au clusters as a function of composition and potential parameterisation. Physical Chemistry Chemical Physics : Pccp. 12: 8607-19. PMID 20623082 DOI: 10.1039/C004044D |
0.403 |
|
| 2010 |
Pacheco-Contreras R, Arteaga-Guerrero A, Borbón-González DJ, Posada-Amarillas A, Schön JC, Johnston RL. Energetic and Structural Analysis of 102-Atom Pd–Pt Nanoparticles: A Composition-Dependent Study Journal of Computational and Theoretical Nanoscience. 7: 199-204. DOI: 10.1166/Jctn.2010.1345 |
0.338 |
|
| 2010 |
Logsdail AJ, Cookson NJ, Horswell SL, Wang ZW, Li ZY, Johnston RL. Theoretical and Experimental Studies of the Optical Properties of Conjoined Gold−Palladium Nanospheres The Journal of Physical Chemistry C. 114: 21247-21251. DOI: 10.1021/Jp108486A |
0.664 |
|
| 2010 |
West PS, Johnston RL, Barcaro G, Fortunelli A. The Effect of CO and H Chemisorption on the Chemical Ordering of Bimetallic Clusters The Journal of Physical Chemistry C. 114: 19678-19686. DOI: 10.1021/Jp108387X |
0.383 |
|
| 2010 |
Núñez S, Johnston RL. Structures and Chemical Ordering of Small Cu−Ag Clusters The Journal of Physical Chemistry C. 114: 13255-13266. DOI: 10.1021/Jp1048088 |
0.46 |
|
| 2009 |
Tran DT, Johnston RL. Theoretical study of Cu(38-n)Au(n) clusters using a combined empirical potential-density functional approach. Physical Chemistry Chemical Physics : Pccp. 11: 10340-9. PMID 19890518 DOI: 10.1039/B912501A |
0.437 |
|
| 2009 |
Logsdail A, Paz-Borbón LO, Johnston RL. Structures and Stabilities of Platinum–Gold Nanoclusters Journal of Computational and Theoretical Nanoscience. 6: 857-866. DOI: 10.1166/Jctn.2009.1118 |
0.71 |
|
| 2009 |
Paz-Borbon LO, Johnston RL, Barcaro G, Fortunelli A. Chemisorption of CO and H on Pd, Pt and Au nanoclusters: a DFT approach The European Physical Journal D. 52: 131-134. DOI: 10.1140/Epjd/E2009-00041-9 |
0.34 |
|
| 2009 |
Kravtsova AN, Mazalova VL, Yalovega GE, Soldatov AV, Johnston RL. Analysis of the X-ray absorption fine structure near the TiL2, 3 edge in free titanium nanoclusters Journal of Surface Investigation-X-Ray Synchrotron and Neutron Techniques. 3: 38-40. DOI: 10.1134/S1027451009010078 |
0.323 |
|
| 2009 |
Borbón-González DJ, Pacheco-Contreras R, Posada-Amarillas A, Schön JC, Johnston RL, Montejano-Carrizales JM. Structural Insights into 19-Atom Pd/Pt Nanoparticles: A Computational Perspective The Journal of Physical Chemistry C. 113: 15904-15908. DOI: 10.1021/Jp904518E |
0.448 |
|
| 2009 |
Pittaway F, Paz-Borbón LO, Johnston RL, Arslan H, Ferrando R, Mottet C, Barcaro G, Fortunelli A. Theoretical Studies of Palladium−Gold Nanoclusters: Pd−Au Clusters with up to 50 Atoms The Journal of Physical Chemistry C. 113: 9141-9152. DOI: 10.1021/Jp9006075 |
0.387 |
|
| 2009 |
Mazalova VL, Soldatov AV, Adam S, Yakovlev A, Möller T, Johnston RL. Small Copper Clusters in Ar Shells: A Study of Local Structure The Journal of Physical Chemistry C. 113: 9086-9091. DOI: 10.1021/Jp809401R |
0.385 |
|
| 2008 |
Ferrando R, Fortunelli A, Johnston RL. Searching for the optimum structures of alloy nanoclusters. Physical Chemistry Chemical Physics : Pccp. 10: 640-9. PMID 19791446 DOI: 10.1039/B709000E |
0.39 |
|
| 2008 |
Chen F, Johnston RL. Energetic, electronic, and thermal effects on structural properties of Ag-Au nanoalloys. Acs Nano. 2: 165-75. PMID 19206560 DOI: 10.1021/Nn700226Y |
0.433 |
|
| 2008 |
Li ZY, Wilcoxon JP, Yin F, Chen Y, Palmer RE, Johnston RL. Structures and optical properties of 4–5 nm bimetallic AgAu nanoparticles Faraday Discussions. 138: 363-373. PMID 18447026 DOI: 10.1039/B708958A |
0.31 |
|
| 2008 |
Paz-Borbón LO, Johnston RL, Barcaro G, Fortunelli A. Structural motifs, mixing, and segregation effects in 38-atom binary clusters. The Journal of Chemical Physics. 128: 134517. PMID 18397087 DOI: 10.1063/1.2897435 |
0.445 |
|
| 2008 |
Ferrando R, Jellinek J, Johnston RL. Nanoalloys: from theory to applications of alloy clusters and nanoparticles. Chemical Reviews. 108: 845-910. PMID 18335972 DOI: 10.1021/Cr040090G |
0.33 |
|
| 2008 |
Li ZY, Young NP, Di Vece M, Palomba S, Palmer RE, Bleloch AL, Curley BC, Johnston RL, Jiang J, Yuan J. Three-dimensional atomic-scale structure of size-selected gold nanoclusters. Nature. 451: 46-8. PMID 18066049 DOI: 10.1038/Nature06470 |
0.385 |
|
| 2008 |
Chen F, Johnston RL. Martensitic transformations in Ag–Au bimetallic core-shell nanoalloys Applied Physics Letters. 92: 023112. DOI: 10.1063/1.2835456 |
0.329 |
|
| 2008 |
Paz-Borbón LO, Gupta A, Johnston RL. Dependence of the structures and chemical ordering of Pd–Pt nanoalloys on potential parameters Journal of Materials Chemistry. 18: 4154. DOI: 10.1039/B805147J |
0.45 |
|
| 2008 |
Chen F, Johnston RL. Charge transfer driven surface segregation of gold atoms in 13-atom Au–Ag nanoalloys and its relevance to their structural, optical and electronic properties Acta Materialia. 56: 2374-2380. DOI: 10.1016/J.Actamat.2008.01.048 |
0.4 |
|
| 2007 |
Paz-Borbón LO, Mortimer-Jones TV, Johnston RL, Posada-Amarillas A, Barcaro G, Fortunelli A. Structures and energetics of 98 atom Pd-Pt nanoalloys: potential stability of the Leary tetrahedron for bimetallic nanoparticles. Physical Chemistry Chemical Physics : Pccp. 9: 5202-8. PMID 19459283 DOI: 10.1039/B707136A |
0.432 |
|
| 2007 |
Zhou Z, Siegler V, Cheung EY, Habershon S, Harris KD, Johnston RL. Advantages of a redefinition of variable-space in direct-space structure solution from powder x-ray diffraction data. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 8: 650-3. PMID 17348052 DOI: 10.1002/Cphc.200600726 |
0.657 |
|
| 2007 |
Curley BC, Rossi G, Ferrando R, Johnston RL. Theoretical study of structure and segregation in 38-atom Ag-Au nanoalloys The European Physical Journal D. 43: 53-56. DOI: 10.1140/Epjd/E2007-00091-Y |
0.413 |
|
| 2007 |
Chen F, Curley BC, Rossi G, Johnston RL. Structure, Melting, and Thermal Stability of 55 Atom Ag−Au Nanoalloys Journal of Physical Chemistry C. 111: 9157-9165. DOI: 10.1021/Jp0717746 |
0.359 |
|
| 2007 |
Curley BC, Johnston RL, Young NP, Li ZY, Di Vece M, Palmer RE, Bleloch AL. Combining theory and experiment to characterize the atomic structures of surface-deposited Au309 clusters Journal of Physical Chemistry C. 111: 17846-17851. DOI: 10.1021/Jp0713099 |
0.451 |
|
| 2007 |
Paz-Borbón LO, Johnston RL, Barcaro G, Fortunelli A. A Mixed Structural Motif in 34-Atom Pd−Pt Clusters The Journal of Physical Chemistry C. 111: 2936-2941. DOI: 10.1021/Jp0674165 |
0.45 |
|
| 2007 |
Totò N, Ferrando R, Johnston RL, Guo Q. Theoretical investigations of nanopatterning on the Au(111) surface Surface Science. 601: 4175-4179. DOI: 10.1016/J.Susc.2007.04.103 |
0.32 |
|
| 2006 |
Cox G, Berry RS, Johnston RL. Characterizing potential surface topographies through the distribution of saddles and minima. The Journal of Physical Chemistry. A. 110: 11543-50. PMID 17020268 DOI: 10.1021/Jp0630572 |
0.357 |
|
| 2006 |
Cox GA, Johnston RL. Analyzing energy landscapes for folding model proteins. The Journal of Chemical Physics. 124: 204714. PMID 16774371 DOI: 10.1063/1.2198537 |
0.33 |
|
| 2006 |
Wilson NT, Bailey MS, Johnston RL. Atom ordering in cuboctahedral Ni–Al nanoalloys Inorganica Chimica Acta. 359: 3649-3658. DOI: 10.1016/J.Ica.2006.02.029 |
0.396 |
|
| 2005 |
Rossi G, Ferrando R, Rapallo A, Fortunelli A, Curley BC, Lloyd LD, Johnston RL. Global optimization of bimetallic cluster structures. II. Size-matched Ag-Pd, Ag-Au, and Pd-Pt systems. The Journal of Chemical Physics. 122: 194309. PMID 16161575 DOI: 10.1063/1.1898224 |
0.392 |
|
| 2005 |
Rapallo A, Rossi G, Ferrando R, Fortunelli A, Curley BC, Lloyd LD, Tarbuck GM, Johnston RL. Global optimization of bimetallic cluster structures. I. Size-mismatched Ag-Cu, Ag-Ni, and Au-Cu systems. The Journal of Chemical Physics. 122: 194308. PMID 16161574 DOI: 10.1063/1.1898223 |
0.349 |
|
| 2005 |
Lloyd LD, Johnston RL, Salhi S. Strategies for increasing the efficiency of a genetic algorithm for the structural optimization of nanoalloy clusters. Journal of Computational Chemistry. 26: 1069-78. PMID 15898107 DOI: 10.1002/Jcc.20247 |
0.382 |
|
| 2005 |
Komatsuzaki T, Hoshino K, Matsunaga Y, Rylance GJ, Johnston RL, Wales DJ. How many dimensions are required to approximate the potential energy landscape of a model protein? The Journal of Chemical Physics. 122: 84714. PMID 15836084 DOI: 10.1063/1.1854123 |
0.309 |
|
| 2004 |
Cheung EY, Harris KD, Johnston RL, Kitchin SJ, Hadden KL, Zakrzewski M. Rationalizing the structural properties of bupivacaine base--a local anesthetic--directly from powder X-ray diffraction data. Journal of Pharmaceutical Sciences. 93: 667-74. PMID 14762905 DOI: 10.1002/Jps.10551 |
0.358 |
|
| 2004 |
Habershon S, Albesa-Jové D, Cheung EY, Turner GW, Johnston RL, Harris KDM. Fundamental Developments in Direct-Space Techniques for Structure Solution from Powder Diffraction Data Materials Science Forum. 11-22. DOI: 10.4028/Www.Scientific.Net/Msf.443-444.11 |
0.661 |
|
| 2004 |
Harris KDM, Habershon S, Cheung EY, Johnston RL. Developments in genetic algorithm techniques for structure solution from powder diffraction data Zeitschrift FüR Kristallographie - Crystalline Materials. 219. DOI: 10.1524/Zkri.219.12.838.55856 |
0.661 |
|
| 2004 |
Alavi A, Brown RJC, Habershon S, Harris KDM, Johnston RL. Ammonium cyanate: a DFT study of crystal structure, rotational barriers and vibrational spectrum Molecular Physics. 102: 869-876. DOI: 10.1080/00268970410001695679 |
0.636 |
|
| 2004 |
Lloyd LD, Johnston RL, Salhi S, Wilson NT. Theoretical investigation of isomer stability in platinum–palladium nanoalloy clusters J. Mater. Chem.. 14: 1691-1704. DOI: 10.1039/B313811A |
0.466 |
|
| 2004 |
Habershon S, Cheung EY, Harris KDM, Johnston RL. Powder Diffraction Indexing as a Pattern Recognition Problem: A New Approach for Unit Cell Determination Based on an Artificial Neural Network The Journal of Physical Chemistry A. 108: 711-716. DOI: 10.1021/Jp0310596 |
0.614 |
|
| 2004 |
Habershon S, Cheung EY, Harris KD, Johnston RL. An efficient algorithm for calculating whole-profile functions in crystal structure solution from powder diffraction data Chemical Physics Letters. 390: 394-398. DOI: 10.1016/J.Cplett.2004.04.031 |
0.658 |
|
| 2004 |
Cox GA, Mortimer-Jones TV, Taylor RP, Johnston RL. Development and optimisation of a novel genetic algorithm for studying model protein folding Theoretical Chemistry Accounts. 112. DOI: 10.1007/S00214-004-0601-4 |
0.308 |
|
| 2003 |
Cheung EY, Harris KD, Johnston RL, Hadden KL, Zakrzewski M. Polymorphism of a novel sodium ion channel blocker. Journal of Pharmaceutical Sciences. 92: 2017-26. PMID 14502541 DOI: 10.1002/Jps.10434 |
0.336 |
|
| 2003 |
Habershon S, Harris KD, Johnston RL. Development of a multipopulation parallel genetic algorithm for structure solution from powder diffraction data. Journal of Computational Chemistry. 24: 1766-74. PMID 12964195 DOI: 10.1002/Jcc.10326 |
0.666 |
|
| 2003 |
Bailey M, Wilson N, Roberts C, Johnston R. Structures, stabilities and ordering in Ni-Al nanoalloy clusters The European Physical Journal D - Atomic, Molecular and Optical Physics. 25: 41-55. DOI: 10.1140/Epjd/E2003-00218-2 |
0.433 |
|
| 2003 |
Johnston RL. Evolving better nanoparticles: Genetic algorithms for optimising cluster geometries Dalton Transactions. 4193-4207. DOI: 10.1039/B305686D |
0.417 |
|
| 2003 |
Lordeiro RA, Guimarães FF, Belchior JC, Johnston RL. Determination of main structural compositions of nanoalloy clusters of CuxAuy(x+y≤ 30) using a genetic algorithm approach International Journal of Quantum Chemistry. 95: 112-125. DOI: 10.1002/Qua.10660 |
0.439 |
|
| 2002 |
Lloyd LD, Johnston RL, Roberts C, Mortimer-Jones TV. Geometry optimisation of aluminium clusters using a genetic algorithm. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 3: 408-15. PMID 12465500 DOI: 10.1002/1439-7641(20020517)3:5<408::Aid-Cphc408>3.0.Co;2-G |
0.419 |
|
| 2002 |
Johnston RL. Atomic and molecular clusters Applied Mathematics and Computation. DOI: 10.1201/9781420055771 |
0.368 |
|
| 2002 |
Cheung EY, Harris KDM, Johnston RL, Turner GW, Habershon S, Jove A. Interpreting structural motifs of molecular materials by way of crystal structure determination directly from powder diffraction data Acta Crystallographica Section a Foundations of Crystallography. 58: c141-c141. DOI: 10.1107/S0108767302090669 |
0.335 |
|
| 2002 |
Harris KDM, Johnston RL, Cheung EY, Turner GW, Habershon S, Jove DA. The development of direct-space techniques for solving crystal structures from powder diffraction data Acta Crystallographica Section a Foundations of Crystallography. 58: c42-c42. DOI: 10.1107/S0108767302086786 |
0.301 |
|
| 2002 |
Harris KDM, Johnston RL, Turner GW, Tedesco E, Cheung EY, Kariuki BM. Recent Advances in the Opportunities for Solving Molecular Crystal Structures Directly from Powder Diffraction Data Molecular Crystals and Liquid Crystals. 389: 123-129. DOI: 10.1080/713738904 |
0.355 |
|
| 2002 |
Guimarães FF, Belchior JC, Johnston RL, Roberts C. Global optimization analysis of water clusters (H[sub 2]O)[sub n] (11≤n≤13) through a genetic evolutionary approach The Journal of Chemical Physics. 116: 8327. DOI: 10.1063/1.1471240 |
0.381 |
|
| 2002 |
Darby S, Mortimer-Jones TV, Johnston RL, Roberts C. Theoretical study of Cu–Au nanoalloy clusters using a genetic algorithm The Journal of Chemical Physics. 116: 1536-1550. DOI: 10.1063/1.1429658 |
0.425 |
|
| 2002 |
Massen C, Mortimer-Jones TV, Johnston RL. Geometries and segregation properties of platinum–palladium nanoalloy clusters Journal of the Chemical Society-Dalton Transactions. 23: 4375-4388. DOI: 10.1039/B207847C |
0.424 |
|
| 2002 |
Wilson NT, Johnston RL. Passivated clusters: a theoretical investigation of the effect of surface ligation on cluster geometry Physical Chemistry Chemical Physics. 4: 4168-4171. DOI: 10.1039/B204460A |
0.399 |
|
| 2002 |
Wilson NT, Johnston RL. A theoretical study of atom ordering in copper–gold nanoalloy clusters J. Mater. Chem.. 12: 2913-2922. DOI: 10.1039/B204069G |
0.422 |
|
| 2002 |
Harris KDM, Johnston RL, Cheung EY, Turner GW, Habershon S, Albesa-Jové D, Tedesco E, Kariuki BM. Recent advances in opportunities for solving molecular crystal structures directly from powder diffraction data: New insights in crystal engineering contexts Crystengcomm. 4: 356-367. DOI: 10.1039/B202832H |
0.656 |
|
| 2002 |
Greig LM, Kariuki BM, Habershon S, Spencer N, Johnston RL, Harris KDM, Philp D. Solid-state and solution phase reactivity of 10-hydroxy-10,9-boroxophenanthrene: a model building block for self-assembly processes New Journal of Chemistry. 26: 701-710. DOI: 10.1039/B110285K |
0.608 |
|
| 2002 |
Habershon S, Harris KDM, Johnston RL, Turner GW, Johnston JM. Gaining insights into the evolutionary behaviour in genetic algorithm calculations, with applications in structure solution from powder diffraction data Chemical Physics Letters. 353: 185-194. DOI: 10.1016/S0009-2614(01)01452-X |
0.655 |
|
| 2002 |
Johnston RL, Mortimer-Jones TV, Roberts C, Darby S, Manby FR. Application of Genetic Algorithms in Nanoscience: Cluster Geometry Optimization Lecture Notes in Computer Science. 92-101. DOI: 10.1007/3-540-46004-7_10 |
0.415 |
|
| 2001 |
Tedesco E, Dhillon SS, Harris KDM, Johnston RL, Turner GW, Kariuki BM. Structure Determination of 4,4'-Trimethylenedipyridine from Powder Diffraction Data Materials Science Forum. 784-788. DOI: 10.4028/Www.Scientific.Net/Msf.378-381.784 |
0.329 |
|
| 2001 |
Harris KDM, Johnston RL, Kariuki BM, Tedesco E, Turner GW. Structure Solution of Molecular Crystals from Powder Diffraction Data Using Genetic Algorithms: Opportunities in Academic and Industrial Research Materials Science Forum. 38-46. DOI: 10.4028/Www.Scientific.Net/Msf.378-381.38 |
0.33 |
|
| 2001 |
Kariuki BM, Harris KDM, Johnston RL. Solving Crystal Structures from Powder Diffraction Data using Genetic Algorithms Molecular Crystals and Liquid Crystals Science and Technology. Section a. Molecular Crystals and Liquid Crystals. 356: 469-481. DOI: 10.1080/10587250108023725 |
0.362 |
|
| 2001 |
Roberts C, Johnston RL. Investigation of the structures of MgO clusters using a genetic algorithm Physical Chemistry Chemical Physics. 3: 5024-5034. DOI: 10.1039/B106507F |
0.424 |
|
| 2001 |
Tedesco E, Harris KDM, Johnston RL, Turner GW, Raja KMP, Balaram P. Ab initio structure determination of a peptideβ-turn from powder X-ray diffraction data Chemical Communications. 1460-1461. DOI: 10.1039/B103876C |
0.343 |
|
| 2001 |
Johnston R. Transition metal carbonyl cluster chemistry Journal of Organometallic Chemistry. 628: 281. DOI: 10.1016/S0022-328X(01)00786-0 |
0.324 |
|
| 2001 |
Tedesco E, Kariuki BM, Harris KD, Johnston RL, Pudova O, Barbarella G, Marseglia EA, Gigli G, Cingolani R. Structural Aspects of High-Efficiency Blue-Emitting 2,5-Bis(trimethylsilyl)thiophene-S,S-dioxide and Related Materials Journal of Solid State Chemistry. 161: 121-128. DOI: 10.1006/Jssc.2001.9298 |
0.33 |
|
| 2000 |
Harris KDM, Tedesco E, Johnston RL, Turner GW, Kariuki BM. New Aspects of Direct Space Structure Solution from Powder Diffraction Data Acta Crystallographica Section a Foundations of Crystallography. 56: s131-s131. DOI: 10.1107/S0108767300023217 |
0.307 |
|
| 2000 |
Turner GW, Johnston RL, Wilson NT. Investigation of geometric shell aluminum clusters using the Gupta many-body potential The Journal of Chemical Physics. 112: 4773-4778. DOI: 10.1063/1.481086 |
0.401 |
|
| 2000 |
Lloyd LD, Johnston RL. Theoretical analysis of 17–19-atom metal clusters using many-body potentials Journal of the Chemical Society-Dalton Transactions. 307-316. DOI: 10.1039/A908003A |
0.403 |
|
| 2000 |
Lanning OJ, Habershon S, Harris KD, Johnston RL, Kariuki BM, Tedesco E, Turner GW. Definition of a `guiding function' in global optimization: a hybrid approach combining energy and R-factor in structure solution from powder diffraction data Chemical Physics Letters. 317: 296-303. DOI: 10.1016/S0009-2614(99)01366-4 |
0.652 |
|
| 2000 |
Turner GW, Tedesco E, Harris KD, Johnston RL, Kariuki BM. Implementation of Lamarckian concepts in a Genetic Algorithm for structure solution from powder diffraction data Chemical Physics Letters. 321: 183-190. DOI: 10.1016/S0009-2614(00)00318-3 |
0.361 |
|
| 2000 |
Wilson N, Johnston R. Modelling gold clusters with an empirical many-body potential The European Physical Journal D. 12: 161-169. DOI: 10.1007/S100530070053 |
0.43 |
|
| 2000 |
Roberts C, Johnston RL, Wilson NT. A genetic algorithm for the structural optimization of Morse clusters Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta). 104: 123-130. DOI: 10.1007/S002140000117 |
0.406 |
|
| 1999 |
Kariuki BM, Calcagno P, Harris KDM, Philp D, Johnston RL. Evolving Opportunities in Structure Solution from Powder Diffraction Data-Crystal Structure Determination of a Molecular System with Twelve Variable Torsion Angles. Angewandte Chemie (International Ed. in English). 38: 831-835. PMID 29711787 DOI: 10.1002/(Sici)1521-3773(19990315)38:6<831::Aid-Anie831>3.0.Co;2-6 |
0.348 |
|
| 1999 |
Kariuki BM, Belmonte SA, McMahon MI, Johnston RL, Harris KDM, Nelmes RJ. A new approach for indexing powder diffraction data based on whole-profile fitting and global optimization using a genetic algorithm Journal of Synchrotron Radiation. 6: 87-92. DOI: 10.1107/S0909049598017932 |
0.305 |
|
| 1999 |
Kariuki BM, Psallidas K, Harris KDM, Johnston RL, Lancaster RW, Staniforth SE, Cooper SM. Structure determination of a steroid directly from powder diffraction data Chemical Communications. 1677-1678. DOI: 10.1039/A904702F |
0.339 |
|
| 1999 |
Hazel C, Johnston RL, Murrell JN. Empirical potentials for modeling solids, surfaces, and clusters Journal of Solid State Chemistry. 145: 517-540. DOI: 10.1006/Jssc.1999.8200 |
0.367 |
|
| 1998 |
Harris KDM, Johnston RL, Kariuki BM. The Genetic Algorithm: Foundations and Apllications in Structure Solution from Powder Diffraction Data Acta Crystallographica Section a Foundations of Crystallography. 54: 632-645. DOI: 10.1107/S0108767398003389 |
0.367 |
|
| 1998 |
Johnston RL. The development of metallic behaviour in clusters Philosophical Transactions of the Royal Society of London. Series a: Mathematical, Physical and Engineering Sciences. 356: 211-230. DOI: 10.1098/Rsta.1998.0158 |
0.374 |
|
| 1998 |
Cox H, Johnston RL, Ward A. An empirical many-body potential energy function for modelling ytterbium Journal of Physics: Condensed Matter. 10: 9419-9429. DOI: 10.1088/0953-8984/10/42/008 |
0.316 |
|
| 1998 |
Harris KD, Kariuki BM, Tremayne M, Johnston RL. New Methodologies for Solving Crystal Structures from Powder Diffraction Data Molecular Crystals and Liquid Crystals Science and Technology. Section a. Molecular Crystals and Liquid Crystals. 313: 1-14. DOI: 10.1080/10587259808044255 |
0.359 |
|
| 1998 |
Harris KDM, Johnston RL, Kariuki BM, Tremayne M. A Genetic Algorithm for Crystal Structure Solution from Powder Diffraction Data Journal of Chemical Research-S. 390-391. DOI: 10.1039/A802319K |
0.353 |
|
| 1997 |
Hearn JE, Johnston RL. Modeling calcium and strontium clusters with many-body potentials The Journal of Chemical Physics. 107: 4674-4687. DOI: 10.1063/1.474829 |
0.416 |
|
| 1997 |
Cox H, Johnston RL, Murrell JN. Modelling of surface relaxation and melting of aluminium Surface Science. 373: 67-84. DOI: 10.1016/S0039-6028(96)01153-3 |
0.301 |
|
| 1997 |
Kariuki BM, Serrano-González H, Johnston RL, Harris KD. The application of a genetic algorithm for solving crystal structures from powder diffraction data Chemical Physics Letters. 280: 189-195. DOI: 10.1016/S0009-2614(97)01156-1 |
0.377 |
|
| 1997 |
Camus S, Harris KD, Johnston RL. Ab initio calculation of 2H quadrupole coupling constants in molecular crystals: application to polymorphs of oxalic acid dihydrate Chemical Physics Letters. 276: 186-195. DOI: 10.1016/S0009-2614(97)00866-X |
0.347 |
|
| 1996 |
Hearn JE, Johnston RL, Leoni S, Murrell JN. Global potentials for calcium and strontium solids Journal of the Chemical Society - Faraday Transactions. 92: 425-432. DOI: 10.1039/Ft9969200425 |
0.343 |
|
| 1995 |
Besley NA, Johnston RL, Stace AJ, Uppenbrink J. Theoretical study of the structures and stabilities of iron clusters Journal of Molecular Structure: Theochem. 341: 75-90. DOI: 10.1016/0166-1280(95)04207-M |
0.412 |
|
| 1994 |
Andersson KM, Johnston RL, Murrell JN. Empirical potential-energy function for calcium solids and clusters. Physical Review. B, Condensed Matter. 49: 3089-3097. PMID 10011164 DOI: 10.1103/Physrevb.49.3089 |
0.378 |
|
| 1994 |
Eggen BR, Johnston RL, Murrell JN. Carbon cluster structures and stabilities predicted from solid-state potentials Journal of the Chemical Society, Faraday Transactions. 90: 3029-3037. DOI: 10.1039/Ft9949003029 |
0.425 |
|
| 1994 |
Johnston RL. Cluster chemistry: Introduction to the chemistry of transition metal and main group element molecular clusters Journal of Organometallic Chemistry. 476: C18. DOI: 10.1016/0022-328X(94)84154-3 |
0.347 |
|
| 1993 |
Fang JY, Johnston RL, Murrell JN. Potential energy functions for atomic solids v. Application to alkali metal solids Molecular Physics. 78: 1405-1422. DOI: 10.1080/00268979300100931 |
0.335 |
|
| 1993 |
Fang JY, Johnston RL, Murrell JN. Potential-energy functions for Cu, Ag and Au solids and their application to clusters of these elements Journal of the Chemical Society, Faraday Transactions. 89: 1659-1665. DOI: 10.1039/Ft9938901659 |
0.361 |
|
| 1992 |
Eggen BR, Johnston RL, Li S, Murrell JN. Potential energy functions for atomic solids iv. Reproducing the properties of more than one solid phase Molecular Physics. 76: 619-633. DOI: 10.1080/00268979200101571 |
0.362 |
|
| 1992 |
Johnston RL, Fang J. An empirical many‐body potential‐energy function for aluminum. Application to solid phases and microclusters The Journal of Chemical Physics. 97: 7809-7821. DOI: 10.1063/1.463450 |
0.37 |
|
| 1992 |
Li S, Johnston RL, Murrell JN. Cluster structures and stabilities from solid-state potentials. Application to silicon clusters Journal of the Chemical Society, Faraday Transactions. 88: 1229-1236. DOI: 10.1039/Ft9928801229 |
0.443 |
|
| 1992 |
Johnston RL, Hoffmann R. Structure-Bonding Relationships in the Laves Phases Zeitschrift F�R Anorganische Und Allgemeine Chemie. 616: 105-120. DOI: 10.1002/Zaac.19926161017 |
0.47 |
|
| 1991 |
Al-Derzi AR, Johnston RL, Murrell JN, Rodriguez-Ruizj JA. Potential energy functions for atomic solids iii. fitting phonon frequencies and elastic constants of diamond structures Molecular Physics. 73: 265-282. DOI: 10.1080/00268979100101191 |
0.332 |
|
| 1991 |
Johnston RL. Closed-shell three-connected clusters: topological and group-theoretical aspects Journal of the Chemical Society, Faraday Transactions. 87: 3353. DOI: 10.1039/Ft9918703353 |
0.365 |
|
| 1990 |
Lichtenberger DL, Johnston RL, Hinkelmann K, Suzuki T, Wudl F. Relative electron donor strengths of tetrathiafulvene derivatives: effects of chemical substitutions and the molecular environment from a combined photoelectron and electrochemical study Journal of the American Chemical Society. 112: 3302-3307. DOI: 10.1021/Ja00165A007 |
0.53 |
|
| 1990 |
Johnston RL, Hoffmann R. The kagomé net: Band theoretical and topological aspects Polyhedron. 9: 1901-1911. DOI: 10.1016/S0277-5387(00)84002-4 |
0.481 |
|
| 1989 |
Johnston RL, Hoffmann R. Superdense carbon, C8: supercubane or analog of .gamma.-silicon? Journal of the American Chemical Society. 111: 810-819. DOI: 10.1021/Ja00185A004 |
0.359 |
|
| 1988 |
Demidowicz Z, Johnston RL, MacHell JC, Mingos DMP, Williams ID. Synthesis and structural characterisation of a novel high-nuclearity gold-tin cluster compound, [Au<inf>8</inf>(PPh<inf>3</inf>)<inf>7</inf>(SnCl<inf>3</inf>)] <inf>2</inf>[SnCl<inf>6</inf>] Journal of the Chemical Society, Dalton Transactions. 1751-1756. DOI: 10.1039/Dt9880001751 |
0.533 |
|
| 1988 |
DEMIDOWICZ Z, JOHNSTON RL, MACHELL JC, MINGOS DMP, WILLIAMS ID. ChemInform Abstract: Synthesis and Structural Characterization of a Novel High-Nuclearity Gold-Tin Cluster Compound, (Au8(PPh3)7(SnCl3))2(SnCl6). Cheminform. 19. DOI: 10.1002/chin.198843319 |
0.454 |
|
| 1987 |
Johnston RL, Mingos DMP. A group theoretical paradigm for describing the skeletal molecular orbitals of cluster compounds. Part 2. Bispherical clusters Journal of the Chemical Society-Dalton Transactions. 1445-1456. DOI: 10.1039/Dt9870001445 |
0.392 |
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| 1986 |
Johnston RL, Minggos DMP. Theoretical analysis of the bonding in octahedral transition-metal clusters containing .mu.-acceptor and .mu.-donor bridging ligands and their nido and arachno derivatives Inorganic Chemistry. 25: 1661-1671. DOI: 10.1021/Ic00230A028 |
0.32 |
|
| 1986 |
Johnston R, Mingos D. The Pairing Principle in Tensor Surface Harmonic Theory: Definition of a general class of N-atom polar deltahedra with N skeletal electron pairs Polyhedron. 5: 2059-2061. DOI: 10.1016/S0277-5387(00)87138-7 |
0.337 |
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