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  • Currently displaying 13161 - 13180 of 30389 publications
Author(s)
Publication title
Journal Name
Publication year
Molecular dynamics simulations of the structure of the graphene–ionic liquid/alkali salt mixtures interface
T Méndez-Morales, J Carrete, M Pérez-Rodríguez, Ó Cabeza, LJ Gallego, RM Lynden-Bell, LM Varela
Phys Chem Chem Phys
(2014)
16
Homo- and heteropolymetallic 3-(2-pyridyl)pyrazolate manganese and rhenium complexes.
M Arroyo, P Gómez-Iglesias, N Antón, R García-Rodríguez, ECBA Alegria, AJL Pombeiro, D Miguel, F Villafañe
Dalton Trans
(2014)
43
The derivative discontinuity of the exchange-correlation functional.
P Mori-Sánchez, AJ Cohen
Physical chemistry chemical physics : PCCP
(2014)
28
Predicting paramagnetic 1H NMR chemical shifts and state-energy separations in spin-crossover host-guest systems
WC Isley, S Zarra, RK Carlson, RA Bilbeisi, TK Ronson, JR Nitschke, L Gagliardi, CJ Cramer
Physical Chemistry Chemical Physics
(2014)
16
Stochastic surface walking method for crystal structure and phase transition pathway prediction
C Shang, X-J Zhang, Z-P Liu
Physical chemistry chemical physics : PCCP
(2014)
16
Synthesis, structure and reactivity of Ni site models of [NiFeSe] hydrogenases.
C Wombwell, E Reisner
Dalton Trans
(2014)
43
Synthesis and structural characterization of a single-crystal to single-crystal transformable coordination polymer
Y Tian, PK Allan, CL Renouf, X He, LJ McCormick, RE Morris
Journal of the Chemical Society Dalton Transactions
(2014)
43
Isoindigo fluorination to enhance photovoltaic performance of donor-acceptor conjugated copolymers.
Y Yang, R Wu, X Wang, X Xu, Z Li, K Li, Q Peng
Chem. Commun.
(2014)
50
Structural, dynamic and photophysical properties of a fluorescent dye incorporated in an amorphous hydrophobic polymer bundle
N De Mitri, G Prampolini, S Monti, V Barone
Phys. Chem. Chem. Phys.
(2014)
16
Brønsted acids in ionic liquids: How acidity depends on the liquid structure
JA McCune, P He, M Petkovic, F Coleman, J Estager, JD Holbrey, KR Seddon, M Swadźba-Kwaśny
Physical Chemistry Chemical Physics
(2014)
16
Shallow-tunnelling correction factor for use with Wigner-Eyring transition-state theory.
Y Zhang, JB Rommel, MT Cvitaš, SC Althorpe
Physical chemistry chemical physics : PCCP
(2014)
16
Supramolecular self-assembled network formation containing N…Br halogen bonds in physisorbed overlayer
AY Brewer, M Sacchi, JE Parker, CL Truscott, SJ Jenkins, SM Clarke
Phys Chem Chem Phys
(2014)
16
Photoelectrochemical reduction of aqueous protons with a CuO|CuBi2O4heterojunction under visible light irradiation
HS Park, C-Y Lee, E Reisner
Physical chemistry chemical physics : PCCP
(2014)
16
Protein film photoelectrochemistry of the water oxidation enzyme photosystem II
M Kato, JZ Zhang, N Paul, E Reisner
Chem. Soc. Rev.
(2014)
43
Fac and mer isomers of Ru(II) tris(pyrazolyl-pyridine) complexes as models for the vertices of coordination cages: structural characterisation and hydrogen-bonding characteristics.
AJ Metherell, W Cullen, A Stephenson, CA Hunter, MD Ward
Dalton Transactions
(2014)
43
Targeting a c-MYC G-quadruplex DNA with a fragment library.
HR Nasiri, NM Bell, KIE McLuckie, J Husby, C Abell, S Neidle, S Balasubramanian
Chem. Commun.
(2014)
50
Hyperpolarisation through reversible interactions with para hydrogen
LS Lloyd, A Asghar, MJ Burns, A Charlton, S Coombes, MJ Cowley, GJ Dear, SB Duckett, GR Genov, GGR Green, LAR Highton, AJJ Hooper, M Khan, IG Khazal, RJ Lewis, RE Mewis, AD Roberts, AJ Ruddlesden
Catalysis Science & Technology
(2014)
4
Folates are potential ligands for ruthenium compounds in vivo
TG Scrase, SM Page, PD Barker, SR Boss
Dalton Transactions
(2014)
43
Supramolecular polymeric peptide amphiphile vesicles for the encapsulation of basic fibroblast growth factor
XJ Loh, J del Barrio, T-C Lee, OA Scherman
Chemical Communications
(2014)
50
New avenues in the directed deprotometallation of aromatics: Recent advances in directed cupration
PJ Harford, AJ Peel, F Chevallier, R Takita, F Mongin, M Uchiyama, AEH Wheatley
Dalton transactions (Cambridge, England : 2003)
(2014)
43