Research outputs
2025
Discovery of Crystalline Inorganic Solids in the Digital Age.
Antypov, D., Vasylenko, A., Collins, C. M., Daniels, L. M., Darling, G. R., Dyer, M. S., . . . Rosseinsky, M. J. (2025). Discovery of Crystalline Inorganic Solids in the Digital Age.. Accounts of chemical research. doi:10.1021/acs.accounts.4c00694
Integration of generative machine learning with the heuristic crystal structure prediction code FUSE.
Collins, C. M., Sayeed, H. M., Darling, G. R., Claridge, J. B., Sparks, T. D., & Rosseinsky, M. J. (2025). Integration of generative machine learning with the heuristic crystal structure prediction code FUSE.. Faraday discussions, 256(0), 85-103. doi:10.1039/d4fd00094c
2024
Recognition and order of multiple sidechains by metal–organic framework enhances the separation of hexane isomers
Markad, D., Kershaw Cook, L. J., Pétuya, R., Yan, Y., Gilford, O., Verma, A., . . . Rosseinsky, M. J. (2024). Recognition and order of multiple sidechains by metal–organic framework enhances the separation of hexane isomers. Angewandte Chemie, 136(50). doi:10.1002/ange.202411960
La Substitution into the Melilite Derivative Ca<sub>5</sub>Ga<sub>6</sub>O<sub>14</sub>: Prediction, Synthesis and Ionic Conductivity.
Bazzaoui, H., Gao, M., Hernandez, O., Chenu, S., He, L., Genevois, C., . . . Pitcher, M. J. (2024). La Substitution into the Melilite Derivative Ca<sub>5</sub>Ga<sub>6</sub>O<sub>14</sub>: Prediction, Synthesis and Ionic Conductivity.. Inorganic chemistry, 63(40), 18902-18913. doi:10.1021/acs.inorgchem.4c03172
Hydroxyl on Stepped Copper and its Interaction with Water.
Mistry, K., Snowden, H., Darling, G. R., & Hodgson, A. (2024). Hydroxyl on Stepped Copper and its Interaction with Water.. The journal of physical chemistry. C, Nanomaterials and interfaces, 128(31), 13025-13033. doi:10.1021/acs.jpcc.4c04091
Statistically derived proxy potentials accelerate geometry optimization of crystal structures.
Antypov, D., Collins, C. M., Vasylenko, A., Gusev, V., Gaultois, M. W., Darling, G. R., . . . Rosseinsky, M. J. (2024). Statistically derived proxy potentials accelerate geometry optimization of crystal structures.. Chemphyschem : a European journal of chemical physics and physical chemistry, e202400254. doi:10.1002/cphc.202400254
Statistical Proxy Potentials
Antypov, D., Collins, C., Vasylenko, A., Gusev, V., Darling, G., Dyer, M., & Rosseinsky, M. (n.d.). Statistical Proxy Potentials. doi:10.17638/datacat.liverpool.ac.uk/1730
Inferring energy-composition relationships with Bayesian optimization enhances exploration of inorganic materials.
Vasylenko, A., Asher, B. M., Collins, C. M., Gaultois, M. W., Darling, G. R., Dyer, M. S., & Rosseinsky, M. J. (2024). Inferring energy-composition relationships with Bayesian optimization enhances exploration of inorganic materials.. The Journal of chemical physics, 160(5), 054110. doi:10.1063/5.0180818
2023
Reinforcement Learning in Crystal Structure Prediction
Zamaraeva, E., Collins, C. M., Antypov, D., Gusev, V. V., Savani, R., Dyer, M. S., . . . Spirakis, P. G. (2023). Reinforcement Learning in Crystal Structure Prediction. Digital Discovery. doi:10.1039/d3dd00063j
Optimality Guarantees for Crystal Structure Prediction
Adamson, D., Gusev, V. V., Deligkas, A., Antypov, D., Collins, C. M., Krysta, P., . . . Rosseinsky, M. J. (2023). Optimality Guarantees for Crystal Structure Prediction. Nature. doi:10.1038/s41586-023-06071-y
Molecular reaction dynamics: surfaces
Darling, G. R., Holloway, S., & Rettner, C. (n.d.). Molecular reaction dynamics: surfaces. In Encyclopedia of Chemical Physics and Physical Chemistry. IOP Publishing Ltd. doi:10.1887/0750303131/b984v1c21
2022
Machine-Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry
Petuya, R., Durdy, S., Antypov, D., Gaultois, M. W., Berry, N. G., Darling, G. R., . . . Rosseinsky, M. J. (2022). Machine-Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 61(9). doi:10.1002/anie.202114573
Machine‐Learning Prediction of Metal–Organic Framework Guest Accessibility from Linker and Metal Chemistry
Pétuya, R., Durdy, S., Antypov, D., Gaultois, M. W., Berry, N. G., Darling, G. R., . . . Rosseinsky, M. J. (2022). Machine‐Learning Prediction of Metal–Organic Framework Guest Accessibility from Linker and Metal Chemistry. Angewandte Chemie, 134(9). doi:10.1002/ange.202114573
2021
Machine Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry
Pétuya, R., Durdy, S., Antypov, D., Gaultois, M., Berry, N., Darling, G., . . . Rosseinsky, M. (n.d.). Machine Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry. doi:10.17638/datacat.liverpool.ac.uk/1494
Discovery of a Low Thermal Conductivity Oxide Guided by Probe Structure Prediction and Machine Learning
Collins, C. M., Daniels, L. M., Gibson, Q., Gaultois, M. W., Moran, M., Feetham, R., . . . Rosseinsky, M. J. (2021). Discovery of a Low Thermal Conductivity Oxide Guided by Probe Structure Prediction and Machine Learning. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 60(30), 16457-16465. doi:10.1002/anie.202102073
Discovery of a low thermal conductivity oxide guided by probe structure prediction and machine learning
Collins, C., Gibson, Q., Daniels, L., Gaultois, M., Moran, M., Feetham, R., . . . Rosseinsky, M. (n.d.). Discovery of a low thermal conductivity oxide guided by probe structure prediction and machine learning. doi:10.17638/datacat.liverpool.ac.uk/1047
2020
Water Dissociation and Hydroxyl Formation on Ni(110)
Gerrard, N., Mistry, K., Darling, G. R., & Hodgson, A. (2020). Water Dissociation and Hydroxyl Formation on Ni(110). JOURNAL OF PHYSICAL CHEMISTRY C, 124(43), 23815-23822. doi:10.1021/acs.jpcc.0c08708
Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests
Yan, Y., Carrington, E. J., Petuya, R., Whitehead, G. F. S., Verma, A., Hylton, R. K., . . . Rosseinsky, M. J. (2020). Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 142(35), 14903-14913. doi:10.1021/jacs.0c03853
Chemically directed structure evolution for crystal structure prediction
Sharp, P. M., Dyer, M. S., Darling, G. R., Claridge, J. B., & Rosseinsky, M. J. (2020). Chemically directed structure evolution for crystal structure prediction. Physical Chemistry Chemical Physics, 22(32), 18205-18218. doi:10.1039/d0cp02206c
Hydration of a 2D Supramolecular Assembly: Bitartrate on Cu(110)
Lin, C., Darling, G. R., Forster, M., McBride, F., Massey, A., & Hodgson, A. (2020). Hydration of a 2D Supramolecular Assembly: Bitartrate on Cu(110). JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 142(32), 13814-13822. doi:10.1021/jacs.0c04747
Amino acid residues determine the response of flexible metal-organic frameworks to guests
Yan, Y., Carrington, E. J., Pétuya, R., Whitehead, G. F. S., Verma, A., Hylton, R. K., . . . Rosseinsky, M. J. (n.d.). Amino acid residues determine the response of flexible metal-organic frameworks to guests. doi:10.17638/datacat.liverpool.ac.uk/996
Formation of Linear Water Chains on Ni(110)
Gerrard, N., Mistry, K., Darling, G. R., & Hodgson, A. (2020). Formation of Linear Water Chains on Ni(110). JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 11(6), 2121-2126. doi:10.1021/acs.jpclett.0c00407
2019
The Anisotropic Responses of a Flexible Metal-Organic Framework Constructed from Asymmetric Flexible Linkers and Heptanuclear Zinc Carboxylate Secondary Building Units
Carrington, E. J., Petuya, R., Hylton, R. K., Yan, Y., Antypov, D., Darling, G. R., . . . Rosseinsky, M. J. (2019). The Anisotropic Responses of a Flexible Metal-Organic Framework Constructed from Asymmetric Flexible Linkers and Heptanuclear Zinc Carboxylate Secondary Building Units. CRYSTAL GROWTH & DESIGN, 19(10), 5604-5618. doi:10.1021/acs.cgd.9b00558
Chemical control of structure and guest uptake by a conformationally mobile porous material
Katsoulidis, A., Antypov, D., Whitehead, G., Carrington, E., Adams, D., Berry, N., . . . Rosseinsky, M. (2019). Chemical control of structure and guest uptake by a conformationally mobile porous material. Nature, 565(7738), 213. doi:10.1038/s41586-018-0820-9
2018
Ice nucleation on a corrugated surface
Lin, C., Corem, G., Godsi, O., Alexandrowicz, G., Darling, G., & Hodgson, A. (2018). Ice nucleation on a corrugated surface. Journal of the American Chemical Society, 140(46), 15804-15811. doi:10.1021/jacs.8b08796
Structure determination and crystal chemistry of large repeat mixed-layer hexaferrites
Delacotte, C., Whitehead, G. F. S., Pitcher, M. J., Robertson, C. M., Sharp, P. M., Dyer, M. S., . . . Rosseinsky, M. J. (2018). Structure determination and crystal chemistry of large repeat mixed-layer hexaferrites. IUCRJ, 5, 681-698. doi:10.1107/S2052252518011351
Chemical control of structure and guest uptake by a conformationally mobile porous material
Katsoulidis, A., Antypov, D., Whitehead, G., Carrington, E., Adams, D., Berry, N., . . . Rosseinsky, M. (n.d.). Chemical control of structure and guest uptake by a conformationally mobile porous material. doi:10.17638/datacat.liverpool.ac.uk/589
Computational Prediction and Experimental Realization of p-Type Carriers in the Wide-Band-Gap Oxide SrZn<sub>1-<i>x</i></sub>Li<i><sub>x</sub></i>O<sub>2</sub>
Tzitzeklis, C. A., Gupta, J. K., Dyer, M. S., Manning, T. D., Pitcher, M. J., Niu, H. J., . . . Rosseinsky, M. J. (2018). Computational Prediction and Experimental Realization of p-Type Carriers in the Wide-Band-Gap Oxide SrZn<sub>1-<i>x</i></sub>Li<i><sub>x</sub></i>O<sub>2</sub>. INORGANIC CHEMISTRY, 57(19), 11874-11883. doi:10.1021/acs.inorgchem.8b00697
Computational prediction and experimental realization of p-type carriers in the wide band-gap oxide SrZn1−xLixO2
Tzitzeklis, C., Gupta, J., Dyer, M., Manning, T., Pitcher, M., Niu, H., . . . Rosseinsky, M. (n.d.). Computational prediction and experimental realization of p-type carriers in the wide band-gap oxide SrZn1−xLixO2. doi:10.17638/datacat.liverpool.ac.uk/433
The Flexible Unit Structure Engine (FUSE) for probe structure-based composition prediction.
Collins, C., Darling, G. R., & Rosseinsky, M. J. (2018). The Flexible Unit Structure Engine (FUSE) for probe structure-based composition prediction.. Faraday discussions. doi:10.1039/c8fd00045j
Two dimensional wetting of a stepped copper surface
Lin, C., Avidor, N., Corem, G., Godsi, O., Alexandrowicz, G., Darling, G. R., & Hodgson, A. (2018). Two dimensional wetting of a stepped copper surface. Physical Review Letters, 120(7). doi:10.1103/PhysRevLett.120.076101
2017
Accelerated discovery of two crystal structure types in a complex inorganic phase field
Collins, C., Dyer, M. S., Pitcher, M. J., Whitehead, G. F. S., Zanella, M., Mandal, P., . . . Rosseinsky, M. J. (2017). Accelerated discovery of two crystal structure types in a complex inorganic phase field. Nature, 546(7657), 280-284. doi:10.1038/nature22374
Chiral segregation driven by a dynamical response of the adsorption footprint to the local adsorption environment: Bitartrate on Cu(110)
darling., forster, M., Lin, C., liu, N., raval, R., & Hodgson, A. (2017). Chiral segregation driven by a dynamical response of the adsorption footprint to the local adsorption environment: Bitartrate on Cu(110). Physical Chemistry Chemical Physics, 19(11), 7617-7623. doi:10.1039/C7CP00622E
2015
1D self-assembly of chemisorbed thymine on Cu(110) driven by dispersion forces
Temprano, I., Thomas, G., Haq, S., Dyer, M. S., Latter, E. G., Darling, G. R., . . . Raval, R. (2015). 1D self-assembly of chemisorbed thymine on Cu(110) driven by dispersion forces. JOURNAL OF CHEMICAL PHYSICS, 142(10). doi:10.1063/1.4907721
2014
The role of lattice parameter in water adsorption and wetting of a solid surface
Massey, A., McBride, F., Darling, G. R., Nakamura, M., & Hodgson, A. (2014). The role of lattice parameter in water adsorption and wetting of a solid surface. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 16(43), 24018-24025. doi:10.1039/c4cp03164d
Reported and predicted structures of Ba(Co,Nb)<sub>1-δ</sub>O<sub>3</sub> hexagonal perovskite phases
Bradley, K. A., Collins, C., Dyer, M. S., Claridge, J. B., Darling, G. R., & Rosseinsky, M. J. (2014). Reported and predicted structures of Ba(Co,Nb)<sub>1-δ</sub>O<sub>3</sub> hexagonal perovskite phases. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 16(39), 21073-21081. doi:10.1039/c4cp01542h
Computational prediction and experimental confirmation of B-site doping in YBa<sub>2</sub>Fe<sub>3</sub>O<sub>8</sub>
Collins, C., Dyer, M. S., Demont, A., Chater, P. A., Thomas, M. F., Darling, G. R., . . . Rosseinsky, M. J. (2014). Computational prediction and experimental confirmation of B-site doping in YBa<sub>2</sub>Fe<sub>3</sub>O<sub>8</sub>. CHEMICAL SCIENCE, 5(4), 1493-1505. doi:10.1039/c3sc52734d
Side-chain control of porosity closure in single- and multiple-peptide-based porous materials by cooperative folding
Martí-Gastaldo, C., Antypov, D., Warren, J., Briggs, M., Chater, P., Wiper, P., . . . Rosseinsky, M. (2014). Side-chain control of porosity closure in single- and multiple-peptide-based porous materials by cooperative folding. Nature Chemistry, 6, 343-351. doi:10.1038/nchem.1871
Guest-Adaptable and Water-Stable Peptide-Based Porous Materials by Imidazolate Side Chain Control
Katsoulidis, A., Park, K. S., Antypov, D., Martí-Gastaldo, C., Miller, G., Warren, J., . . . Rosseinsky, M. (2014). Guest-Adaptable and Water-Stable Peptide-Based Porous Materials by Imidazolate Side Chain Control. Angewandte Chemie International Edition, 53(1), 193-198. doi:10.1002/anie.201307074
2013
Computationally Assisted Identification of Functional Inorganic Materials
Dyer, M. S., Collins, C., Hodgeman, D., Chater, P. A., Demont, A., Romani, S., . . . Rosseinsky, M. J. (2013). Computationally Assisted Identification of Functional Inorganic Materials. SCIENCE, 340(6134), 847-852. doi:10.1126/science.1226558
The Influence of Water and Hydroxyl on a Bimetallic (√3 x √3)R30° Sn/Pt Surface Alloy
McBride, F., Darling, G. R., Pussi, K., Lucas, C. A., Gruender, Y., Darlington, M., . . . Hodgson, A. (2013). The Influence of Water and Hydroxyl on a Bimetallic (√3 x √3)R30° Sn/Pt Surface Alloy. JOURNAL OF PHYSICAL CHEMISTRY C, 117(8), 4032-4039. doi:10.1021/jp3112342
2012
Artificial Construction of the Layered Ruddlesden-Popper Manganite La<sub>2</sub>Sr<sub>2</sub>Mn<sub>3</sub>O<sub>10</sub> by Reflection High Energy Electron Diffraction Monitored Pulsed Laser Deposition
Palgrave, R. G., Borisov, P., Dyer, M. S., McMitchell, S. R. C., Darling, G. R., Claridge, J. B., . . . Rosseinsky, M. J. (2012). Artificial Construction of the Layered Ruddlesden-Popper Manganite La<sub>2</sub>Sr<sub>2</sub>Mn<sub>3</sub>O<sub>10</sub> by Reflection High Energy Electron Diffraction Monitored Pulsed Laser Deposition. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 134(18), 7700-7714. doi:10.1021/ja211138x
Chemical Bonding and Atomic Structure in Y<sub>2</sub>O<sub>3</sub>:ZrO<i>2</i>-SrTiO<i>3</i> Layered Heterostructures
Dyer, M. S., Darling, G. R., Claridge, J. B., & Rosseinsky, M. J. (2012). Chemical Bonding and Atomic Structure in Y<sub>2</sub>O<sub>3</sub>:ZrO<i>2</i>-SrTiO<i>3</i> Layered Heterostructures. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 51(14), 3418-3422. doi:10.1002/anie.201108068
Strain relief and disorder in commensurate water layers formed on Pd(111)
McBride, F., Omer, A., Clay, C. M., Cummings, L., Darling, G. R., & Hodgson, A. (2012). Strain relief and disorder in commensurate water layers formed on Pd(111). JOURNAL OF PHYSICS-CONDENSED MATTER, 24(12). doi:10.1088/0953-8984/24/12/124102
2011
The Solid-State Structures of Dimethylzinc and Diethylzinc
Bacsa, J., Hanke, F., Hindley, S., Odedra, R., Darling, G. R., Jones, A. C., & Steiner, A. (2011). The Solid-State Structures of Dimethylzinc and Diethylzinc. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 50(49), 11685-11687. doi:10.1002/anie.201105099
Dynamic chiral flipping within strongly chemisorbed molecular monolayers at surfaces
Liu, N., Darling, G. R., & Raval, R. (2011). Dynamic chiral flipping within strongly chemisorbed molecular monolayers at surfaces. CHEMICAL COMMUNICATIONS, 47(40), 11324-11326. doi:10.1039/c1cc13317a
Tailoring the Structure of Water at a Metal Surface: A Structural Analysis of the Water Bilayer Formed on an Alloy Template
McBride, F., Darling, G. R., Pussi, K., & Hodgson, A. (2011). Tailoring the Structure of Water at a Metal Surface: A Structural Analysis of the Water Bilayer Formed on an Alloy Template. PHYSICAL REVIEW LETTERS, 106(22). doi:10.1103/PhysRevLett.106.226101
2010
Stabilization of a Complex Perovskite Superstructure under Ambient Conditions: Influence of Cation Composition and Ordering, and Evaluation as an SOFC Cathode
Demont, A., Dyer, M. S., Sayers, R., Thomas, M. F., Tsiamtsouri, M., Niu, H. N., . . . Rosseinsky, M. J. (2010). Stabilization of a Complex Perovskite Superstructure under Ambient Conditions: Influence of Cation Composition and Ordering, and Evaluation as an SOFC Cathode. CHEMISTRY OF MATERIALS, 22(24), 6598-6615. doi:10.1021/cm102475n
An Adaptable Peptide-Based Porous Material
Rabone, J., Yue, Y. -F., Chong, S. Y., Stylianou, K. C., Bacsa, J., Bradshaw, D., . . . Rosseinsky, M. J. (2010). An Adaptable Peptide-Based Porous Material. SCIENCE, 329(5995), 1053-1057. doi:10.1126/science.1190672
Polymorphism control of superconductivity and magnetism in Cs<sub>3</sub>C<sub>60</sub> close to the Mott transition
Ganin, A. Y., Takabayashi, Y., Jeglic, P., Arcon, D., Potocnik, A., Baker, P. J., . . . Prassides, K. (2010). Polymorphism control of superconductivity and magnetism in Cs<sub>3</sub>C<sub>60</sub> close to the Mott transition. NATURE, 466(7303), 221-U93. doi:10.1038/nature09120
Role of the self-interaction error in studying chemisorption on graphene from first-principles
Casolo, S., Flage-Larsen, E., Lovvik, O. M., Darling, G. R., & Tantardini, G. F. (2010). Role of the self-interaction error in studying chemisorption on graphene from first-principles. PHYSICAL REVIEW B, 81(20). doi:10.1103/PhysRevB.81.205412
Surface Scattering: Molecular Collisions at Interfaces
Hodgson, A., & Darling, G. (2010). Surface Scattering: Molecular Collisions at Interfaces. In M. Brouard, & C. Vallance (Eds.), Molecular Reaction Dynamics at Surfaces (pp. 333-362). Cambridge: RSC.
2009
Magnesium Borohydride Confined in a Metal-Organic Framework: A Preorganized System for Facile Arene Hydroboration
Ingleson, M. F., Barrio, J. P., Bacsa, J., Steiner, A., Darling, G. R., Jones, J. T. A., . . . Rosseinsky, M. J. (2009). Magnesium Borohydride Confined in a Metal-Organic Framework: A Preorganized System for Facile Arene Hydroboration. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 48(11), 2012-2016. doi:10.1002/anie.200804196
2008
Order and disorder in the wetting layer on Ru(0001)
Gallagher, M., Omer, A., Darling, G. R., & Hodgson, A. (2009). Order and disorder in the wetting layer on Ru(0001). FARADAY DISCUSSIONS, 141, 231-249. doi:10.1039/b807809b
Chapter 5 Intra-molecular Energy Flow in Gas–Surface Collisions
Darling, G. R. (2008). Chapter 5 Intra-molecular Energy Flow in Gas–Surface Collisions. Elsevier. doi:10.1016/s1573-4331(08)00005-x
Chiral II-VI Semiconductor Nanostructure Superlattices Based on an Amino Acid Ligand
Rebilly, J. -N., Gardner, P. W., Darling, G. R., Bacsa, J., & Rosseinsky, M. J. (2008). Chiral II-VI Semiconductor Nanostructure Superlattices Based on an Amino Acid Ligand. INORGANIC CHEMISTRY, 47(20), 9390-9399. doi:10.1021/ic801097w
Intermolecular overlap geometry gives two classes of fulleride superconductor:: Electronic structure of 38 K <i>T<sub>c</sub></i> Cs<sub>3</sub>C<sub>60</sub>
Darling, G. R., Ganin, A. Y., Rosseinsky, M. J., Takabayashi, Y., & Prassides, K. (2008). Intermolecular overlap geometry gives two classes of fulleride superconductor:: Electronic structure of 38 K <i>T<sub>c</sub></i> Cs<sub>3</sub>C<sub>60</sub>. PHYSICAL REVIEW LETTERS, 101(13). doi:10.1103/PhysRevLett.101.136404
Wetting of mixed OH/H<sub>2</sub>O layers on pt(111)
Zimbitas, G., Gallagher, M. E., Darling, G. R., & Hodgson, A. (2008). Wetting of mixed OH/H<sub>2</sub>O layers on pt(111). JOURNAL OF CHEMICAL PHYSICS, 128(7). doi:10.1063/1.2830266
The chemical response of main-group extended solids to formal mixed valency:: the case of Li<sub>x</sub>BC
Fogg, A. M., Darling, G. R., Claridge, J. B., Meldrum, J., & Rosseinsky, M. J. (2008). The chemical response of main-group extended solids to formal mixed valency:: the case of Li<sub>x</sub>BC. PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, 366(1862), 55-62. doi:10.1098/rsta.2007.2139
"Naked" fluoride binding sites for physisorptive hydrogen storage
Trewin, A., Darling, G. R., & Cooper, A. I. (2008). "Naked" fluoride binding sites for physisorptive hydrogen storage. NEW JOURNAL OF CHEMISTRY, 32(1), 17-20. doi:10.1039/b714593d
Intermolecular Overlap Geometry Gives Two Classes of Fulleride Superconductor: Electronic Structure of 38 K<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi>T</mml:mi><mml:mi>c</mml:mi></mml:msub></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi>Cs</mml:mi><mml:mn>3</mml:mn></mml:msub><mml:msub><mml:mi mathvariant="normal">C</mml:mi><mml:mn>60</mml:mn></mml:msub></mml:math>
Darling, G. R., Ganin, A. Y., Rosseinsky, M. J., Takabayashi, Y., & Prassides, K. (2008). Intermolecular Overlap Geometry Gives Two Classes of Fulleride Superconductor: Electronic Structure of 38 K<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi>T</mml:mi><mml:mi>c</mml:mi></mml:msub></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi>Cs</mml:mi><mml:mn>3</mml:mn></mml:msub><mml:msub><mml:mi mathvariant="normal">C</mml:mi><mml:mn>60</mml:mn></mml:msub></mml:math>. Physical Review Letters, 101(13). doi:10.1103/physrevlett.101.136404
Intra-molecular Energy Flow in Gas-Surface Collisions
Darling, G. R. (2008). Intra-molecular Energy Flow in Gas-Surface Collisions. In DYNAMICS (Vol. 3, pp. 141-195). doi:10.1016/S1573-4331(08)00005-X
2007
Dissociative adsorption of water at vacancy defects in graphite
Cabrera-Sanfelix, P., & Darling, G. R. (2007). Dissociative adsorption of water at vacancy defects in graphite. JOURNAL OF PHYSICAL CHEMISTRY C, 111(49), 18258-18263. doi:10.1021/jp076241b
Monolayer adsorption of water on NaCl(100)
Cabrera-Sanfelix, P., Holloway, S., & Darling, G. R. (2007). Monolayer adsorption of water on NaCl(100). APPLIED SURFACE SCIENCE, 254(1), 87-91. doi:10.1016/j.apsusc.2007.07.043
Direct visualization of enantiospecific substitution of chiral guest molecules into heterochiral molecular assemblies at surfaces
Liu, N., Haq, S., Darling, G. R., & Raval, R. (2007). Direct visualization of enantiospecific substitution of chiral guest molecules into heterochiral molecular assemblies at surfaces. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 46(40), 7613-7616. doi:10.1002/anie.200701675
On the structure of the first hydration layer on NaCl(100): Role of hydrogen bonding
Cabrera-Sanfelix, P., Arnau, A., Darling, G. R., & Sanchez-Portal, D. (2007). On the structure of the first hydration layer on NaCl(100): Role of hydrogen bonding. JOURNAL OF CHEMICAL PHYSICS, 126(21). doi:10.1063/1.2743411
Spontaneous emergence of Cl<SUP>-</SUP> anions from NaCl(100) at low relative humidity
Cabrera-Sanfelix, P., Portal, D. S., Verdaguer, A., Darling, G. R., Salmeron, M., & Arnau, A. (2007). Spontaneous emergence of Cl<SUP>-</SUP> anions from NaCl(100) at low relative humidity. JOURNAL OF PHYSICAL CHEMISTRY C, 111(22), 8000-8004. doi:10.1021/jp070548t
2006
Water adsorption and diffusion on NaCl(100)
Cabrera-Sanfelix, P., Arnau, A., Darling, G. R., & Sanchez-Portal, D. (2006). Water adsorption and diffusion on NaCl(100). JOURNAL OF PHYSICAL CHEMISTRY B, 110(48), 24559-24564. doi:10.1021/jp062462q
Protons colliding with ice: Bouncing, sticking, splashing
Al-Halabi, A., Sanfelix, P. C., Holloway, S., Kroes, G. -J., & Darling, G. R. (2006). Protons colliding with ice: Bouncing, sticking, splashing. SURFACE SCIENCE, 600(18), 4247-4250. doi:10.1016/j.susc.2006.01.151
Chemical control of electronic structure and superconductivity in layered borides and borocarbides:: Understanding the absence of superconductivity in Li<i><sub>x</sub></i>BC
Fogg, A. M., Meldrum, J., Darling, G. R., Claridge, J. B., & Rosseinsky, M. J. (2006). Chemical control of electronic structure and superconductivity in layered borides and borocarbides:: Understanding the absence of superconductivity in Li<i><sub>x</sub></i>BC. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 128(31), 10043-10053. doi:10.1021/ja0578449
Growth of intact water ice on Ru(0001) between 140 and 160 K: Experiment and density-functional theory calculations
Haq, S., Clay, C., Darling, G. R., Zimbitas, G., & Hodgson, A. (2006). Growth of intact water ice on Ru(0001) between 140 and 160 K: Experiment and density-functional theory calculations. PHYSICAL REVIEW B, 73(11). doi:10.1103/PhysRevB.73.115414
2005
Computational studies of nonadiabatic effects in gas-surface encounters
Corriol, C., Darling, G. R., & Holloway, S. (2005). Computational studies of nonadiabatic effects in gas-surface encounters. ISRAEL JOURNAL OF CHEMISTRY, 45(1-2), 1-12. doi:10.1560/N4Y8-FEX5-AC2B-VK14
Electronic structure, magnetic ordering, and formation pathway of the transition metal oxide hydride LaSrCoO<sub>3</sub>H<sub>0.7</sub>
Bridges, C. A., Darling, G. R., Hayward, M. A., & Rosseinsky, M. J. (2005). Electronic structure, magnetic ordering, and formation pathway of the transition metal oxide hydride LaSrCoO<sub>3</sub>H<sub>0.7</sub>. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 127(16), 5996-6011. doi:10.1021/ja042683e
Protons colliding with crystalline ice: Proton reflection and collision induced water desorption at low incidence energies
Sanfelix, P. C., Al-Halabi, A., Darling, G. R., Holloway, S., & Kroes, G. J. (2005). Protons colliding with crystalline ice: Proton reflection and collision induced water desorption at low incidence energies. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 127(11), 3944-3951. doi:10.1021/ja040171u
2004
Molecular trapping in the dissociation dynamics of N<sub>2</sub> on W(110)
Corriol, C., & Darling, G. R. (2004). Molecular trapping in the dissociation dynamics of N<sub>2</sub> on W(110). SURFACE SCIENCE, 557(1-3), L156-L162. doi:10.1016/j.susc.2004.03.039
The surface temperature dependence of the inelastic scattering and dissociation of hydrogen molecules from metal surfaces
Wang, Z. S., Darling, G. R., & Holloway, S. (2004). The surface temperature dependence of the inelastic scattering and dissociation of hydrogen molecules from metal surfaces. JOURNAL OF CHEMICAL PHYSICS, 120(6), 2923-2933. doi:10.1063/1.1636724
2003
Vibrational properties of hexagonal LiBC: Infrared and Raman spectroscopy
Hlinka, J., Železný, V., Gregora, I., Pokorný, J., Fogg, A. M., Claridge, J. B., . . . Rosseinsky, M. J. (2003). Vibrational properties of hexagonal LiBC: Infrared and Raman spectroscopy. Physical Review B Condensed Matter and Materials Physics, 68(22). doi:10.1103/PhysRevB.68.220510
Steering in non-dissociative chernisorption: ethylene on Ag(410)
Savio, L., Vattuone, L., Rocca, M., Corriol, C., Darling, G. R., & Holloway, S. (2003). Steering in non-dissociative chernisorption: ethylene on Ag(410). CHEMICAL PHYSICS LETTERS, 382(5-6), 605-610. doi:10.1016/j.cplett.2003.10.100
H2 dissociation dynamics on metals: where do we stand?
Darling, G. R., & Holloway, S. (2003). H2 dissociation dynamics on metals: where do we stand?. Elsevier. doi:10.1016/s1571-0785(03)11002-4
Vibrational properties of hexagonal LiBC: Infrared and Raman spectroscopy
Hlinka, J., Zelezny, V., Gregora, I., Pokorny, J., Fogg, A. M., Claridge, J. B., . . . Rosseinsky, M. J. (2003). Vibrational properties of hexagonal LiBC: Infrared and Raman spectroscopy. PHYSICAL REVIEW B, 68(22). doi:10.1103/PhysRevB.68.220510
The Mott-Hubbard insulating state and orbital degeneracy in the superconducting C<sub>60</sub><SUP>3-</SUP> fulleride family
Durand, P., Darling, G. R., Dubitsky, Y., Zaopo, A., & Rosseinsky, M. J. (2003). The Mott-Hubbard insulating state and orbital degeneracy in the superconducting C<sub>60</sub><SUP>3-</SUP> fulleride family. NATURE MATERIALS, 2(9), 605-610. doi:10.1038/nmat953
Synthesis and characteristion of Li<i><sub>x</sub></i>BC -: hole doping does not induce superconductivity
Fogg, A. M., Claridge, J. B., Darling, G. R., & Rosseinsky, M. J. (2003). Synthesis and characteristion of Li<i><sub>x</sub></i>BC -: hole doping does not induce superconductivity. CHEMICAL COMMUNICATIONS, (12), 1348-1349. doi:10.1039/b302058d
LiBC electronic, vibrational, structural, and low-temperature chemical behavior of a layered material isoelectronic with MgB2
Fogg, A. M., Chalker, P. R., Claridge, J. B., Darling, G. R., & Rosseinsky, M. J. (2003). LiBC electronic, vibrational, structural, and low-temperature chemical behavior of a layered material isoelectronic with MgB2. Physical Review B Condensed Matter and Materials Physics, 67(24). doi:10.1103/PhysRevB.67.245106
LiBC electronic, vibrational, structural, and low-temperature chemical behavior of a layered material isoelectronic with MgB<sub>2</sub> -: art. no. 245106
Fogg, A. M., Chalker, P. R., Claridge, J. B., Darling, G. R., & Rosseinsky, M. J. (2003). LiBC electronic, vibrational, structural, and low-temperature chemical behavior of a layered material isoelectronic with MgB<sub>2</sub> -: art. no. 245106. PHYSICAL REVIEW B, 67(24). doi:10.1103/PhysRevB.67.245106
Angular dependence of dissociation in steering dominated activated reaction
Corriol, C., Darling, G. R., & Holloway, S. (2003). Angular dependence of dissociation in steering dominated activated reaction. SURFACE SCIENCE, 532, 198-205. doi:10.1016/S0039-6028(03)00120-1
The potential energy surface for dissociation of N<sub>2</sub> on W(100)
Serrano, M., & Darling, G. R. (2003). The potential energy surface for dissociation of N<sub>2</sub> on W(100). SURFACE SCIENCE, 532, 206-212. doi:10.1016/S0039-6028(03)00210-3
The structure of water on the (0001) surface of graphite
Sanfelix, P. C., Holloway, S., Kolasinski, K. W., & Darling, G. R. (2003). The structure of water on the (0001) surface of graphite. SURFACE SCIENCE, 532, 166-172. doi:10.1016/S0039-6028(03)00161-4
Incidence angle dependence of scattering and dissociation of O<sub>2</sub> on Al(111):: Possible weakly bound molecular precursors
Weisse, O., Wesenberg, C., Binetti, M., Hasselbrink, E., Corriol, C., Darling, G. R., & Holloway, S. (2003). Incidence angle dependence of scattering and dissociation of O<sub>2</sub> on Al(111):: Possible weakly bound molecular precursors. JOURNAL OF CHEMICAL PHYSICS, 118(17), 8010-8015. doi:10.1063/1.1563611
Time-dependent quantum calculations of negative ion formation in scattering of atoms from alkali-halide surfaces
Darling, G. R., Kosloff, R., & Zeiri, Y. (2003). Time-dependent quantum calculations of negative ion formation in scattering of atoms from alkali-halide surfaces. SURFACE SCIENCE, 528(1-3), 84-90. doi:10.1016/S0039-6028(02)02614-6
Vibrational heating in electron stimulated desorption of CO from transition metals: a classical mechanics analysis
Corriol, C., Darling, G. R., Holloway, S., Andrianov, I., Klamroth, T., & Saalfrank, P. (2003). Vibrational heating in electron stimulated desorption of CO from transition metals: a classical mechanics analysis. SURFACE SCIENCE, 528(1-3), 27-34. doi:10.1016/S0039-6028(02)02606-7
2002
Energy exchange in reactive scattering of hydrogen molecules from a Cu surface
Darling, G. R., Wang, Z. S., & Holloway, S. (2002). Energy exchange in reactive scattering of hydrogen molecules from a Cu surface. CHEMICAL PHYSICS LETTERS, 365(1-2), 157-163. doi:10.1016/S0009-2614(02)01410-0
Theory of electron stimulated desorption and dissociation of CO at transition metals
Corriol, C., Darling, G. R., Holloway, S., Brenig, W., Andrianov, I., Klamroth, T., & Saalfrank, P. (2002). Theory of electron stimulated desorption and dissociation of CO at transition metals. JOURNAL OF CHEMICAL PHYSICS, 117(9), 4489-4498. doi:10.1063/1.1498474
Flexible sorption and transformation behavior in a microporous metal-organic framework
Cussen, E. J., Claridge, J. B., Rosseinsky, M. J., & Kepert, C. J. (2002). Flexible sorption and transformation behavior in a microporous metal-organic framework. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 124(32), 9574-9581. doi:10.1021/ja0262737
Test of approximations to surface motion in gas-surface dynamics:: Linear versus quadratic coupling for <i>T</i><sub>s</sub>=0 K
Wang, Z. S., Darling, G. R., Jackson, B., & Holloway, S. (2002). Test of approximations to surface motion in gas-surface dynamics:: Linear versus quadratic coupling for <i>T</i><sub>s</sub>=0 K. JOURNAL OF PHYSICAL CHEMISTRY B, 106(33), 8422-8428. doi:10.1021/jp020938+
Vibration-rotational coupling of H<sub>2</sub> molecules scattering from a Cu(111) surface
Wang, Z. S., Darling, G. R., & Holloway, S. (2002). Vibration-rotational coupling of H<sub>2</sub> molecules scattering from a Cu(111) surface. SURFACE SCIENCE, 504(1-3), 66-74. doi:10.1016/S0039-6028(01)01853-2
2001
Dissociation dynamics from a de Broglie-Bohm perspective
Wang, Z. S., Darling, G. R., & Holloway, S. (2001). Dissociation dynamics from a de Broglie-Bohm perspective. JOURNAL OF CHEMICAL PHYSICS, 115(22), 10373-10381. doi:10.1063/1.1415450
Surface temperature dependence of the inelastic scattering of hydrogen molecules from metal surfaces
Wang, Z. S., Darling, G. R., & Holloway, S. (2001). Surface temperature dependence of the inelastic scattering of hydrogen molecules from metal surfaces. PHYSICAL REVIEW LETTERS, 87(22). doi:10.1103/PhysRevLett.87.226102
Surface temperature dependence of the inelastic scattering of hydrogen molecules from metal surfaces
Wang, Z. S., Darling, G. R., & Holloway, S. (2001). Surface temperature dependence of the inelastic scattering of hydrogen molecules from metal surfaces. Physical Review Letters, 87(22), 226102/4.
Dissociation dynamics from a de Broglie-Bohm perspective
Wang, Z. S., Darling, G. R., & Holloway, S. (2001). Dissociation dynamics from a de Broglie-Bohm perspective. JOURNAL OF CHEMICAL PHYSICS, 115(22), 10373-10381.
2000
Translation-to-rotational energy transfer in scattering of H<sub>2</sub> molecules from Cu(111) surfaces
Wang, Z. S., Darling, G. R., & Holloway, S. (2000). Translation-to-rotational energy transfer in scattering of H<sub>2</sub> molecules from Cu(111) surfaces. SURFACE SCIENCE, 458(1-3), 63-70. doi:10.1016/S0039-6028(00)00389-7
Exploring the applicability of classical mechanics in H<sub>2</sub> scattering and reaction at metal surfaces
Darling, G. R., Wang, Z. S., & Holloway, S. (2000). Exploring the applicability of classical mechanics in H<sub>2</sub> scattering and reaction at metal surfaces. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2(4), 911-917. doi:10.1039/a908386c
Charge-transfer reactions in atom scattering from ionic surfaces: A time-dependent wavepacket approach
Darling, G. R., Zeiri, Y., & Kosloff, R. (2000). Charge-transfer reactions in atom scattering from ionic surfaces: A time-dependent wavepacket approach. FARADAY DISCUSSIONS, 117, 41-54. doi:10.1039/b004003g
1999
Analysis of a semi-quantal method for molecular dynamics
Harris, D. C., Darling, G. R., & Holloway, S. (1999). Analysis of a semi-quantal method for molecular dynamics. SURFACE SCIENCE, 433, 838-842. doi:10.1016/S0039-6028(99)00051-5
1998
Comparing quantum and classical dynamics:: H<sub>2</sub> dissociation on W(100)
Kay, M., Darling, G. R., & Holloway, S. (1998). Comparing quantum and classical dynamics:: H<sub>2</sub> dissociation on W(100). JOURNAL OF CHEMICAL PHYSICS, 108(11), 4614-4627. doi:10.1063/1.475872
The steering of molecules in simple dissociation reactions
Darling, G. R., Kay, M., & Holloway, S. (1998). The steering of molecules in simple dissociation reactions. SURFACE SCIENCE, 400(1-3), 314-328. doi:10.1016/S0039-6028(97)00887-X
Angular dependence of the dissociation of H<sub>2</sub> on Cu(111) in the tunnelling regime
Darling, G. R., & Holloway, S. (1998). Angular dependence of the dissociation of H<sub>2</sub> on Cu(111) in the tunnelling regime. FARADAY DISCUSSIONS, 110, 253-266. Retrieved from https://www.webofscience.com/
1997
A comparison of quantum and classical dynamics of H-2 scattering from Cu(111)
Kinnersley, A. D., Darling, G. R., & Holloway, S. (1997). A comparison of quantum and classical dynamics of H-2 scattering from Cu(111). SURFACE SCIENCE, 377(1-3), 563-566. doi:10.1016/S0039-6028(96)01483-5
Effect of initial rotations on the sticking of NO on Pt(111)
Kinnersley, A. D., Darling, G. R., & Holloway, S. (1997). Effect of initial rotations on the sticking of NO on Pt(111). SURFACE SCIENCE, 377(1-3), 567-571. doi:10.1016/S0039-6028(96)01482-3
Adiabatic analysis of quantum dynamics
Darling, G. R., Kay, M., & Holloway, S. (1997). Adiabatic analysis of quantum dynamics. PHYSICAL REVIEW LETTERS, 78(9), 1731-1734. doi:10.1103/PhysRevLett.78.1731
1996
A comparison of quantum and classical dynamics of H-2 dissociation on Cu(111)
Kinnersley, A. D., Darling, G. R., Holloway, S., & Hammer, B. (1996). A comparison of quantum and classical dynamics of H-2 dissociation on Cu(111). SURFACE SCIENCE, 364(3), 219-234. doi:10.1016/0039-6028(96)00632-2
How far can classical mechanics be trusted when treating surface reactions?
Holloway, S., Kay, M., & Darling, G. R. (1996). How far can classical mechanics be trusted when treating surface reactions?. FARADAY DISCUSSIONS, 105, 209-223. doi:10.1039/fd9960500209
Quantum versus classical dynamics in hydrogen dissociation
Kinnersley, A. D., Darling, G. R., Holloway, S., & Hammer, B. (1996). Quantum versus classical dynamics in hydrogen dissociation. Surface Science, 364(3), 219-234.
1995
The dissociation of diatomic molecules at surfaces
Darling, G. R., & Holloway, S. (1995). The dissociation of diatomic molecules at surfaces. REPORTS ON PROGRESS IN PHYSICS, 58(12), 1595-1672. doi:10.1088/0034-4885/58/12/001
DISSOCIATIVE ADSORPTION OF H-2 - TIME-DEPENDENT QUANTUM STUDIES
HOLLOWAY, S., & DARLING, G. R. (1995). DISSOCIATIVE ADSORPTION OF H-2 - TIME-DEPENDENT QUANTUM STUDIES. APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING, 61(5), 511-517. doi:10.1007/s003390050233
STEERING EFFECTS IN NONACTIVATED ADSORPTION
KAY, M., DARLING, G. R., HOLLOWAY, S., WHITE, J. A., & BIRD, D. M. (1995). STEERING EFFECTS IN NONACTIVATED ADSORPTION. CHEMICAL PHYSICS LETTERS, 245(2-3), 311-318. doi:10.1016/0009-2614(95)00975-A
THEORY OF LASER-INDUCED DESORPTION OF AMMONIA FROM CU(111) - STATE-RESOLVED DYNAMICS, ISOTOPE EFFECTS, AND SELECTIVE SURFACE PHOTOCHEMISTRY
SAALFRANK, P., HOLLOWAY, S., & DARLING, G. R. (1995). THEORY OF LASER-INDUCED DESORPTION OF AMMONIA FROM CU(111) - STATE-RESOLVED DYNAMICS, ISOTOPE EFFECTS, AND SELECTIVE SURFACE PHOTOCHEMISTRY. JOURNAL OF CHEMICAL PHYSICS, 103(15), 6720-6734. doi:10.1063/1.470351
Erratum to “Surface temperature effects in the dissociative adsorption of D2/Cu(111) revisited” [surface science 321 (1994) L189]
Darling, G. R., & Holloway, S. (1995). Erratum to “Surface temperature effects in the dissociative adsorption of D2/Cu(111) revisited” [surface science 321 (1994) L189]. Surface Science, 336(3), L771. doi:10.1016/0039-6028(95)80046-8
HOT-ELECTRON MEDIATED PHOTODESORPTION - A TIME-DEPENDENT APPROACH APPLIED TO NO/PT(111)
HARRIS, S. M., HOLLOWAY, S., & DARLING, G. R. (1995). HOT-ELECTRON MEDIATED PHOTODESORPTION - A TIME-DEPENDENT APPROACH APPLIED TO NO/PT(111). JOURNAL OF CHEMICAL PHYSICS, 102(20), 8235-8248. doi:10.1063/1.469234
1994
SURFACE-TEMPERATURE EFFECTS IN THE DISSOCIATIVE ADSORPTION OF D-2/CU(111) REVISITED
DARLING, G. R., & HOLLOWAY, S. (1994). SURFACE-TEMPERATURE EFFECTS IN THE DISSOCIATIVE ADSORPTION OF D-2/CU(111) REVISITED. SURFACE SCIENCE, 321(3), L189-L194. doi:10.1016/0039-6028(94)90173-2
A THEORETICAL-STUDY OF THE VIBRATIONAL-EXCITATION OF NO/AG(111)
GATES, G. A., DARLING, G. R., & HOLLOWAY, S. (1994). A THEORETICAL-STUDY OF THE VIBRATIONAL-EXCITATION OF NO/AG(111). JOURNAL OF CHEMICAL PHYSICS, 101(7), 6281-6288. doi:10.1063/1.468382
ROTATIONAL MOTION AND THE DISSOCIATION OF H-2 ON CU(111)
DARLING, G. R., & HOLLOWAY, S. (1994). ROTATIONAL MOTION AND THE DISSOCIATION OF H-2 ON CU(111). JOURNAL OF CHEMICAL PHYSICS, 101(4), 3268-3281. doi:10.1063/1.467574
DISSOCIATION THRESHOLDS AND THE VIBRATIONAL-EXCITATION PROCESS IN THE SCATTERING OF H-2
DARLING, G. R., & HOLLOWAY, S. (1994). DISSOCIATION THRESHOLDS AND THE VIBRATIONAL-EXCITATION PROCESS IN THE SCATTERING OF H-2. SURFACE SCIENCE, 307, 153-158. doi:10.1016/0039-6028(94)90386-7
THE ROLE OF PARALLEL MOMENTUM IN THE DISSOCIATIVE ADSORPTION OF H-2 AT HIGHLY CORRUGATED SURFACES
DARLING, G. R., & HOLLOWAY, S. (1994). THE ROLE OF PARALLEL MOMENTUM IN THE DISSOCIATIVE ADSORPTION OF H-2 AT HIGHLY CORRUGATED SURFACES. SURFACE SCIENCE, 304(3), L461-L467. doi:10.1016/0039-6028(94)91328-5
NONADIABATIC EFFECTS IN THE FRAGMENTATION OF H2 AT SURFACES
GATES, G. A., DARLING, G. R., & HOLLOWAY, S. (1994). NONADIABATIC EFFECTS IN THE FRAGMENTATION OF H2 AT SURFACES. CHEMICAL PHYSICS, 179(2), 199-213. doi:10.1016/0301-0104(93)E0375-6
1993
HOW STEEPLY CURVED REACTION PATHS INFLUENCE DISSOCIATION AND VIBRATIONAL-EXCITATION PROCESSES
DARLING, G. R., & HOLLOWAY, S. (1993). HOW STEEPLY CURVED REACTION PATHS INFLUENCE DISSOCIATION AND VIBRATIONAL-EXCITATION PROCESSES. JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA, 64-5, 571-576. doi:10.1016/0368-2048(93)80123-4
GENERAL DISCUSSION
POLANYI, J. C., EWING, G. E., HARRIS, A., HEIDBERG, J., STOLTE, S., ZEIRI, Y., . . . ROBERTS, M. W. (1993). GENERAL DISCUSSION. FARADAY DISCUSSIONS, 96, 189-215. doi:10.1039/fd9939600189
GENERAL DISCUSSION
HOPKINSON, A., HARRIS, J., POLANYI, J. C., AUERBACH, D. J., RETTNER, C. T., MICHELSEN, H. A., . . . UZER, T. (1993). GENERAL DISCUSSION. FARADAY DISCUSSIONS, 96, 67-93. doi:10.1039/fd9939600067
ROTATIONAL EFFECTS IN THE DISSOCIATIVE ADSORPTION OF H-2 ON CU(111)
DARLING, G. R., & HOLLOWAY, S. (1993). ROTATIONAL EFFECTS IN THE DISSOCIATIVE ADSORPTION OF H-2 ON CU(111). FARADAY DISCUSSIONS, 96, 43-54. doi:10.1039/fd9939600043
1992
ANGULAR AND VIBRATIONAL EFFECTS IN THE STICKING AND SCATTERING OF H2
DARLING, G. R., & HOLLOWAY, S. (1992). ANGULAR AND VIBRATIONAL EFFECTS IN THE STICKING AND SCATTERING OF H2. JOURNAL OF CHEMICAL PHYSICS, 97(7), 5182-5192. doi:10.1063/1.463817
TRANSLATION-TO-VIBRATIONAL EXCITATION IN THE DISSOCIATIVE ADSORPTION OF D2
DARLING, G. R., & HOLLOWAY, S. (1992). TRANSLATION-TO-VIBRATIONAL EXCITATION IN THE DISSOCIATIVE ADSORPTION OF D2. JOURNAL OF CHEMICAL PHYSICS, 97(1), 734-736. doi:10.1063/1.463574
ENHANCED DIFFRACTION OF VIBRATIONALLY EXCITED MOLECULES FROM SURFACES
DARLING, G. R., & HOLLOWAY, S. (1992). ENHANCED DIFFRACTION OF VIBRATIONALLY EXCITED MOLECULES FROM SURFACES. CHEMICAL PHYSICS LETTERS, 191(5), 396-400. doi:10.1016/0009-2614(92)85398-T
VIBRATIONAL EFFECTS IN THE ASSOCIATIVE DESORPTION OF H-2
DARLING, G. R., & HOLLOWAY, S. (1992). VIBRATIONAL EFFECTS IN THE ASSOCIATIVE DESORPTION OF H-2. SURFACE SCIENCE, 268(1-3), L305-L310. doi:10.1016/0039-6028(92)90940-8
1991
ANGULAR-DEPENDENCE OF STICKING AND SCATTERING FROM A REACTIVE SURFACE
DARLING, G. R., & HOLLOWAY, S. (1991). ANGULAR-DEPENDENCE OF STICKING AND SCATTERING FROM A REACTIVE SURFACE. SURFACE SCIENCE, 244(1-2), L81-L86. Retrieved from https://www.webofscience.com/
1990
RESONANCE-MEDIATED DISSOCIATIVE ADSORPTION OF HYDROGEN
DARLING, G. R., & HOLLOWAY, S. (1990). RESONANCE-MEDIATED DISSOCIATIVE ADSORPTION OF HYDROGEN. JOURNAL OF CHEMICAL PHYSICS, 93(12), 9145-9156. doi:10.1063/1.459204
1989
A THEORETICAL-STUDY OF THE STRUCTURE AND REACTIVITY OF CARBON AND GRAPHITE LAYERS ON NICKEL SURFACES
DARLING, G. R., PENDRY, J. B., & JOYNER, R. W. (1989). A THEORETICAL-STUDY OF THE STRUCTURE AND REACTIVITY OF CARBON AND GRAPHITE LAYERS ON NICKEL SURFACES. SURFACE SCIENCE, 221(1-2), 69-90. doi:10.1016/0039-6028(89)90567-0
Theoretical Calculations on the Stability of Carbide Layers at Transition Metal Surfaces
Darling, G. R., Joyner, R. W., & Pendry, J. B. (1989). Theoretical Calculations on the Stability of Carbide Layers at Transition Metal Surfaces. Unknown Journal, 335-345. doi:10.1016/s0167-2991(08)60696-5
1988
STABILITY OF BULK AND SURFACE CARBIDE LAYERS AND THEIR RELATION TO THE FISCHER-TROPSCH HYDROCARBON SYNTHESIS
JOYNER, R. W., DARLING, G. R., & PENDRY, J. B. (1988). STABILITY OF BULK AND SURFACE CARBIDE LAYERS AND THEIR RELATION TO THE FISCHER-TROPSCH HYDROCARBON SYNTHESIS. SURFACE SCIENCE, 205(3), 513-522. doi:10.1016/0039-6028(88)90300-7