Author/Creator: Yates, Jonathan R. - British Library Electronic Legal Deposit Catalogue-Journal Issues and Articles Search Results

Author/Creator Yates, Jonathan R.

1. Ab initio random structure searching of organic molecular solids: assessment and validation against experimental data. Issue 38 (25th September 2017)

Authors:: Zilka, Miri; Dudenko, Dmytro V.; Hughes, Colan E.; Williams, P. Andrew; Sturniolo, Simone; Franks, W. Trent; Pickard, Chris J.; Yates, Jonathan R.; Harris, Kenneth D. M.; Brown, Steven P.
Journal:: Physical chemistry chemical physics
Issue:: Volume 19:Issue 38(2017)
Page Start:: 25949
Record Type:: Journal Article
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2. An NMR crystallography investigation of furosemide. (11th October 2018)

Authors:: Zilka, Miri; Yates, Jonathan R.; Brown, Steven P.
Other Names:: Baias Maria guestEditor.
Journal:: Magnetic resonance in chemistry
Issue:: Volume 57:Number 5(2019)
Page Start:: 191
Record Type:: Journal Article
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3. ChemInform Abstract: Density Functional Theory in the Solid State. Issue 32 (22nd July 2016)

Authors:: Hasnip, Philip J.; Refson, Keith; Probert, Matt I. J.; Yates, Jonathan R.; Clark, Stewart J.; Pickard, Chris J.
Journal:: ChemInform
Issue:: Volume 47:Issue 32(2016)
Page Start:: no
Record Type:: Journal Article
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4. ChemInform Abstract: First‐Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist′s Point of View. Issue 8 (1st March 2013)

Authors:: Bonhomme, Christian; Gervais, Christel; Babonneau, Florence; Coelho, Cristina; Pourpoint, Frederique; Azais, Thierry; Ashbrook, Sharon E.; Griffin, John M.; Yates, Jonathan R.; Mauri, Francesco; et al., et al.
Journal:: ChemInform
Issue:: Volume 44:Issue 8(2013)
Page Start:: no
Record Type:: Journal Article
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5. Crystal Structure of the ZrO Phase at Zirconium/Zirconium Oxide Interfaces1. Issue 2 (27th June 2014)

Authors:: Nicholls, Rebecca J.; Ni, Na; Lozano‐Perez, Sergio; London, Andrew; McComb, David W.; Nellist, Peter D.; Grovenor, Chris R.M.; Pickard, Chris J.; Yates, Jonathan R.
Journal:: Advanced engineering materials
Issue:: Volume 17:Issue 2(2015:Feb.)
Page Start:: 211
Record Type:: Journal Article
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6. Mapping of N−C Bond Formation from a Series of Crystalline Peri‐Substituted Naphthalenes by Charge Density and Solid‐State NMR Methodologies. (1st October 2021)

Authors:: Rees, Gregory J.; Pitak, Mateusz B.; Lari, Alberth; Day, Stephen P.; Yates, Jonathan R.; Gierth, Peter; Barnsley, Kristian; Smith, Mark E.; Coles, Simon J.; Hanna, John V.; Wallis, John D.
Journal:: Angewandte Chemie
Issue:: Volume 133:Number 44(2021)
Page Start:: 24071
Record Type:: Journal Article
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7. Mapping of N−C Bond Formation from a Series of Crystalline Peri‐Substituted Naphthalenes by Charge Density and Solid‐State NMR Methodologies. Issue 44 (1st October 2021)

Authors:: Rees, Gregory J.; Pitak, Mateusz B.; Lari, Alberth; Day, Stephen P.; Yates, Jonathan R.; Gierth, Peter; Barnsley, Kristian; Smith, Mark E.; Coles, Simon J.; Hanna, John V.; Wallis, John D.
Journal:: Angewandte Chemie international edition
Issue:: Volume 60:Issue 44(2021)
Page Start:: 23878
Record Type:: Journal Article
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8. Measuring multiple 17O–13C J-couplings in naphthalaldehydic acid: a combined solid state NMR and density functional theory approach. Issue 6 (27th January 2020)

Authors:: Rees, Gregory J.; Day, Stephen P.; Barnsley, Kristian E.; Iuga, Dinu; Yates, Jonathan R.; Wallis, John D.; Hanna, John V.
Journal:: Physical chemistry chemical physics
Issue:: Volume 22:Issue 6(2020)
Page Start:: 3400
Record Type:: Journal Article
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9. Reducing the computational cost of NMR crystallography of organic powders at natural isotopic abundance with the help of 13C‐13C dipolar couplings. (11th March 2019)

Authors:: Thureau, Pierre; Sturniolo, Simone; Zilka, Miri; Ziarelli, Fabio; Viel, Stéphane; Yates, Jonathan R.; Mollica, Giulia
Other Names:: Baias Maria guestEditor.
Journal:: Magnetic resonance in chemistry
Issue:: Volume 57:Number 5(2019)
Page Start:: 256
Record Type:: Journal Article
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