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- Currently displaying 12581 - 12600 of 29634 publications
Supramolecular self-assembled network formation containing N···Br halogen bonds in physisorbed overlayers.
Phys Chem Chem Phys
(2014)
16
19608
(doi: 10.1039/c4cp03379e)
Synthesis, structure and reactivity of Ni site models of [NiFeSe] hydrogenases.
Dalton Transactions
(2014)
43
4483
(doi: 10.1039/c3dt52967c)
Shallow-tunnelling correction factor for use with Wigner-Eyring transition-state theory
Phys. Chem. Chem. Phys.
(2014)
16
24292
(doi: 10.1039/c4cp03235g)
Brønsted acids in ionic liquids: How acidity depends on the liquid structure
Physical Chemistry Chemical Physics
(2014)
16
23233
(doi: 10.1039/c4cp03217a)
Structural, dynamic and photophysical properties of a fluorescent dye incorporated in an amorphous hydrophobic polymer bundle
Physical Chemistry Chemical Physics
(2014)
16
16573
(doi: 10.1039/c4cp01828a)
Stochastic surface walking method for crystal structure and phase transition pathway prediction.
Phys. Chem. Chem. Phys.
(2014)
16
17845
(doi: 10.1039/c4cp01485e)
Predicting paramagnetic 1 H NMR chemical shifts and state-energy separations in spin-crossover host–guest systems
Phys. Chem. Chem. Phys.
(2014)
16
10620
(doi: 10.1039/c4cp01478b)
The derivative discontinuity of the exchange-correlation functional.
Phys Chem Chem Phys
(2014)
28
14378
(doi: 10.1039/c4cp01170h)
Synthesis and structural characterization of a single-crystal to single-crystal transformable coordination polymer
Dalton Transactions
(2014)
43
1519
(doi: 10.1039/c3dt52579a)
A conformational factorisation approach for estimating the binding free energies of macromolecules.
Physical Chemistry Chemical Physics
(2014)
16
2842
(doi: 10.1039/c3cp53537a)
Molecular dynamics simulations of the structure of the graphene-ionic liquid/alkali salt mixtures interface.
Phys. Chem. Chem. Phys.
(2014)
16
13271
(doi: 10.1039/c4cp00918e)
Solid-state photoreactivity of 9-substituted acridizinium bromide salts
Crystengcomm
(2014)
16
10830
(doi: 10.1039/c4ce01622j)
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.
Dalton transactions (Cambridge, England : 2003)
(2014)
43
71
(doi: 10.1039/c3dt52479e)
Polymorphism of felodipine co-crystals with 4,4′-bipyridine
CrystEngComm
(2014)
16
6603
(doi: 10.1039/c4ce00756e)
Variation of sigma-hole magnitude with M valence electron population in MXnY4−nmolecules (n = 1–4; M = C, Si, Ge; X, Y = F, Cl, Br)
Phys. Chem. Chem. Phys.
(2014)
16
669
(doi: 10.1039/c3cp53738b)
Room temperature hydrophosphination using a simple iron salen pre-catalyst
Chemical Communications
(2014)
50
12109
(doi: 10.1039/c4cc06526c)
Polaron stability in semiconducting polymer neat films.
Chemical communications (Cambridge, England)
(2014)
50
14425
(doi: 10.1039/c4cc06193d)
Proton reduction by molecular catalysts in water under demanding atmospheres.
Chem. Commun.
(2014)
50
15995
(doi: 10.1039/c4cc06159d)
On the coordination chemistry of phosphinecarboxamide: assessing ligand basicity
Chem. Commun.
(2014)
50
12281
(doi: 10.1039/c4cc06094f)
Reactivity of C–H bonds of polychlorobenzenes for palladium-catalysed direct arylations with aryl bromides
Catalysis Science and Technology
(2014)
4
352
(doi: 10.1039/c3cy00757j)
