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Page 1
Structure searching methods: general discussion.
Addicoat M, Adjiman CS, Arhangelskis M, Beran GJO, Brandenburg JG, Braun DE, Burger V, Burow A, Collins C, Cooper A, Day GM, Deringer VL, Dyer MS, Hare A, Jelfs KE, Keupp J, Konstantinopoulos S, Li Y, Ma Y, Marom N, McKay D, Mellot-Draznieks C, Mohamed S, Neumann M, Nilsson Lill S, Nyman J, Oganov AR, Price SL, Reutzel-Edens S, Ruggiero M, Sastre G, Schmid R, Schmidt J, Schön JC, Spackman P, Tsuzuki S, Woodley SM, Yang S, Zhu Q. Addicoat M, et al. Among authors: tsuzuki s. Faraday Discuss. 2018 Oct 26;211(0):133-180. doi: 10.1039/c8fd90030b. Faraday Discuss. 2018. PMID: 30307457 No abstract available.
Applications of crystal structure prediction - organic molecular structures: general discussion.
Adjiman CS, Brandenburg JG, Braun DE, Cole J, Collins C, Cooper AI, Cruz-Cabeza AJ, Day GM, Dudek M, Hare A, Iuzzolino L, McKay D, Mitchell JBO, Mohamed S, Neelamraju S, Neumann M, Nilsson Lill S, Nyman J, Oganov AR, Price SL, Pulido A, Reutzel-Edens S, Rietveld I, Ruggiero MT, Schön JC, Tsuzuki S, van den Ende J, Woollam G, Zhu Q. Adjiman CS, et al. Among authors: tsuzuki s. Faraday Discuss. 2018 Oct 26;211(0):493-539. doi: 10.1039/c8fd90032a. Faraday Discuss. 2018. PMID: 30285020 No abstract available.
Crystal structure evaluation: calculating relative stabilities and other criteria: general discussion.
Addicoat M, Adjiman CS, Arhangelskis M, Beran GJO, Bowskill D, Brandenburg JG, Braun DE, Burger V, Cole J, Cruz-Cabeza AJ, Day GM, Deringer VL, Guo R, Hare A, Helfferich J, Hoja J, Iuzzolino L, Jobbins S, Marom N, McKay D, Mitchell JBO, Mohamed S, Neumann M, Nilsson Lill S, Nyman J, Oganov AR, Piaggi P, Price SL, Reutzel-Edens S, Rietveld I, Ruggiero M, Ryder MR, Sastre G, Schön JC, Taylor C, Tkatchenko A, Tsuzuki S, van den Ende J, Woodley SM, Woollam G, Zhu Q. Addicoat M, et al. Among authors: tsuzuki s. Faraday Discuss. 2018 Oct 26;211(0):325-381. doi: 10.1039/C8FD90031K. Faraday Discuss. 2018. PMID: 30302459 No abstract available.
Structure and dynamics of ionic liquids: general discussion.
Addicoat M, Atkin R, Canongia Lopes JN, Costa Gomes M, Firestone M, Gardas R, Halstead S, Hardacre C, Hardwick LJ, Holbrey J, Hunt P, Ivaništšev V, Jacquemin J, Jones R, Kirchner B, Lynden-Bell R, MacFarlane D, Marlair G, Medhi H, Mezger M, Pádua A, Pantenburg I, Perkin S, Reid JESJ, Rutland M, Saha S, Shimizu K, Slattery JM, Swadźba-Kwaśny M, Tiwari S, Tsuzuki S, Uralcan B, van den Bruinhorst A, Watanabe M, Wishart J. Addicoat M, et al. Among authors: tsuzuki s. Faraday Discuss. 2018 Jan 1;206:291-337. doi: 10.1039/C7FD90092A. Epub 2017 Nov 30. Faraday Discuss. 2018. PMID: 29188846 No abstract available.
Ionic liquids at interfaces: general discussion.
Abbott A, Addicoat M, Aldous L, Bhuin RG, Borisenko N, Canongia Lopes JN, Clark R, Coles S, Costa Gomes M, Cross B, Everts J, Firestone M, Gardas R, Gras M, Halstead S, Hardacre C, Holbrey J, Itoh T, Ivaništšev V, Jacquemin J, Jessop P, Jones R, Kirchner B, Li S, Lynden-Bell R, MacFarlane D, Maier F, Mezger M, Pádua A, Pavel OD, Perkin S, Purcell S, Rutland M, Slattery JM, Suzer S, Tamura K, Thomas ML, Tiwari S, Tsuzuki S, Uralcan B, Wallace W, Watanabe M, Wishart J. Abbott A, et al. Among authors: tsuzuki s. Faraday Discuss. 2018 Jan 1;206:549-586. doi: 10.1039/C7FD90094E. Epub 2017 Dec 4. Faraday Discuss. 2018. PMID: 29199731 No abstract available.
Beyond the halogen bond: general discussion.
Aakeröy CB, Alavi S, Beer PD, Beyeh NK, Brammer L, Bryce DL, Clark T, Cottrell SJ, Del Bene JE, Edwards AJ, Esterhuysen C, Friščić T, Guru Row TN, Kennepohl P, Lloyd GO, Roy Choudhury A, Scheiner S, Southern SA, Taylor MS, Tsuzuki S, Vargas-Baca I. Aakeröy CB, et al. Among authors: tsuzuki s. Faraday Discuss. 2017 Oct 13;203:227-244. doi: 10.1039/c7fd90062g. Faraday Discuss. 2017. PMID: 28971194 No abstract available.
Phase behaviour and thermodynamics: general discussion.
Abbott A, Abe H, Aldous L, Atkin R, Bendová M, Busato M, Canongia Lopes JN, Costa Gomes M, Cross B, Dietz C, Everts J, Firestone M, Gardas R, Gras M, Greaves T, Halstead S, Hardacre C, Harper J, Holbrey J, Jacquemin J, Jessop P, MacFarlane D, Maier F, Medhi H, Mezger M, Pádua A, Perkin S, Reid JESJ, Saha S, Slattery JM, Thomas ML, Tiwari S, Tsuzuki S, Uralcan B, Watanabe M, Wishart J, Youngs T. Abbott A, et al. Among authors: tsuzuki s. Faraday Discuss. 2017 Dec 14;206:113-139. doi: 10.1039/c7fd90091k. Faraday Discuss. 2017. PMID: 29185568 No abstract available.
Computational approaches and sigma-hole interactions: general discussion.
Aakeröy CB, Alavi S, Brammer L, Bryce DL, Clark T, Del Bene JE, Edwards AJ, Esterhuysen C, Guru Row TN, Kennepohl P, Legon AC, Lloyd GO, Murray JS, Pennington WT, Politzer P, Riley KE, Rosokha SV, Scheiner S, Tsuzuki S, Vargas-Baca I. Aakeröy CB, et al. Among authors: tsuzuki s. Faraday Discuss. 2017 Sep 29. doi: 10.1039/c7fd90061a. Online ahead of print. Faraday Discuss. 2017. PMID: 28960014 No abstract available.
Solid-state chemistry and applications: general discussion.
Aakeröy CB, Alavi S, Beyeh NK, Brammer L, Branca M, Bryce DL, Christopherson JC, Clark T, Cottrell SJ, Del Bene JE, Dichiarante V, Edwards AJ, Erdelyi M, Esterhuysen C, Fourmigué M, Friščić T, Kennepohl P, Legon AC, Lloyd GO, Murray JS, Mustoe CL, Pennington WT, Rosokha SV, Roy Choudhury A, Scheiner S, Szell PMJ, Taylor MS, Tsuzuki S. Aakeröy CB, et al. Among authors: tsuzuki s. Faraday Discuss. 2017 Oct 13;203:459-483. doi: 10.1039/c7fd90064c. Faraday Discuss. 2017. PMID: 28967659 No abstract available.
The halogen bond in solution: general discussion.
Aakeröy CB, Beer PD, Beyeh NK, Brammer L, Branca M, Bryce DL, Del Bene JE, Edwards AJ, Erdelyi M, Esterhuysen C, Fourmigué M, Kennepohl P, Lee LM, Mosquera MEG, Murray JS, Mustoe CL, Pennington WT, Politzer P, Riley KE, Rosokha SV, Scheiner S, Taylor MS, Tsuzuki S, Vargas-Baca I, Xu Y. Aakeröy CB, et al. Among authors: tsuzuki s. Faraday Discuss. 2017 Sep 29;203(Advance Articles). doi: 10.1039/c7fd90063e. Online ahead of print. Faraday Discuss. 2017. PMID: 28960018 No abstract available.
670 results