PCCP. Physical Chemistry Chemical Physics - An International Journal
Die Inhaltsverzeichnisse werden automatisch erzeugt und basieren auf den im Index des TIB-Portals verfügbaren Einzelnachweisen der enthaltenen Beiträge. Die Anzeige der Inhaltsverzeichnisse kann daher unvollständig oder lückenhaft sein.
Inhaltsverzeichnis
- 4
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Chemical bonding-induced rich electronic properties of oxygen adsorbed few-layer graphenesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06897eLin, Ming-Fa et al. | 2016
- 37
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Probing the interactions of phenol with oxygenated functional groups on curved fullerene-like sheets in activated carbonElectronic supplementary information (ESI) available: Illustration of optimized phenol adsorption process for condition "10" in animated movie format and comparison of the effects of basis sets: 6-31G(d,p) and 6-311G (Table S1). See DOI: 10.1039/c5cp06089cGoh, Bee-Min et al. | 2016
- 39
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High temperature oxidation of iron-iron oxide core-shell nanowires composed of iron nanoparticlesElectronic supplementary information (ESI) available: Information about the origin of hydrogen during iron nanowire formation and Fig. S1 (EDX spectra of as-prepared iron nanowires), S2 (elemental mapping spectra for as-prepared iron nanowires and nanowires annealed at 300 °C, 600 °C and 800 °C), S3 (XRD patterns collected between 42° and 48° for iron nanowires annealed at 500 °C, 600 °C, 700 °C and 800 °C) and S4 (all collected Mössbauer spectra). See DOI: 10.1039/c5cp07569fBorysiuk, J et al. | 2016
- 4008
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Deconstructing field-induced ketene isomerization through Lagrangian descriptorsCraven, Galen T. / Hernandez, Rigoberto et al. | 2016
- 342
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Formation of GaP nanocones and micro-mesas by metal-assisted chemical etchingElectronic supplementary information (ESI) available: Experimental methods and possible dissolution and re-deposition chemistry of Pd during MaCE. SEM images of the etched GaP without a metal catalyst and morphology variations depending on the bath compositions, and anisotropic etching characteristics. Plot of anisotropic etching characteristic. See DOI: 10.1039/c5cp07863fOh, Jihun et al. | 2016
- 343
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A new medium for triplet-triplet annihilated upconversion and photocatalytic applicationElectronic supplementary information (ESI) available: Details of absorption, photoluminescence, and upconversion in aprotic solvents and photos of different solutions. See DOI: 10.1039/c5cp05288bYe, Changqing et al. | 2016
- 349
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Effect of band structure on the hot-electron transfer over Au photosensitized brookite TiO2Electronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06874fXu, Hua et al. | 2016
- 351
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Molecular dynamics of the Bacillus subtilis expansin EXLX1: interaction with substrates and structural basis of the lack of activity of mutantsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06674cSilveira, Rodrigo L et al. | 2016
- 353
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Evaluating bulk Nb2O2F3 for Li-battery electrode applicationsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06829kAhuja, Rajeev et al. | 2016
- 354
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Assembly of polyaniline nanotubes by interfacial polymerization for corrosion protectionElectronic supplementary information (ESI) available: UV-visible spectra of the solubilization method to determine the critical micellar concentration of decyl and benzylphosphonic acid. Images of PVB coated steel panel without and with PANI at different concentrations (0.5, 2 and 15 wt%) around the scribe area after 20 days salt spray testing. EDS analysis of the defect area of PVB coatings loaded with PANI-DPA (a) and with PANI-BPA (b) after 20 days salt spray testing. See DOI: 10.1039/c5cp06473bPerrin, F. X et al. | 2016
- 3606
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Dielectric depolarisation and concerted collective dynamics in AOT reverse micelles with and without ubiquitinSchmollngruber, Michael / Braun, Daniel / Oser, Daniel et al. | 2016
- 373
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Structure and dynamics of the aliphatic cholesterol side chain in membranes as studied by 2H NMR spectroscopy and molecular dynamics simulationElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp05084gVogel, Alexander et al. | 2016
- 3706
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Self-generated concentration and modulus gradient coating design to protect Si nano-wire electrodes during lithiationKim, Sung-Yup / Ostadhossein, Alireza / van Duin, Adri C. T. et al. | 2016
- 378
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High-performance lithium storage in an ultrafine manganese fluoride nanorod anode with enhanced electrochemical activation based on conversion reactionElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07361hLu, Yan et al. | 2016
- 3804
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Association of defects in doped non-stoichiometric ceria from first principlesGrieshammer, Steffen / Nakayama, Masanobu / Martin, Manfred et al. | 2016
- 391
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A new potassium-based intermediate and its role in the desorption properties of the K-Mg-N-H systemElectronic supplementary information (ESI) available: Additional diffractograms for the characterization of the reaction products and intermediates. DSC trace of K2Mg(NH2)4. See DOI: 10.1039/c5cp06963gMilanese, C et al. | 2016
- 4102
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Computational investigation of structure, dynamics and nucleation kinetics of a family of modified Stillinger–Weber model fluids in bulk and free-standing thin filmsGianetti, Melisa M. / Haji-Akbari, Amir / Paula Longinotti, M. et al. | 2016
- 419
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The formation of heterointerface defects in Au/Cu films on Si substrates under direct current in a vacuum ultraviolet environmentElectronic supplementary information (ESI) available: AES depth profile, Cu LMM Auger lines and crystallographic data. See DOI: 10.1039/c5cp06499fYao, Wenqing et al. | 2016
- 4201
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Analytic calculations of anharmonic infrared and Raman vibrational spectraCornaton, Yann / Ringholm, Magnu / Louant, Orian et al. | 2016
- 426
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Efficient electron-promoted desorption of benzene from water ice surfacesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06537bMarchione, Demian et al. | 2016
- 435
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Improving dipolar recoupling for site-specific structural and dynamics studies in biosolids NMR: windowed RN-symmetry sequencesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07818kLu, Xingyu et al. | 2016
- 451
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Computational methods for the description of pharmacologically relevant platinum complexes - molecular structure and bond dissociationElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp03391hGalgonek, Jakub et al. | 2016
- 471
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Deuteron NMR resolved mesogen vs. crosslinker molecular order and reorientational exchange in liquid single crystal elastomersElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06207aZupan i, B et al. | 2016
- 4078
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Ab initio modelling of magnetic anisotropy in Sr3NiPtO6Pradipto, A.-M. / Broer, R. / Picozzi, S. et al. | 2016
- 486
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Controlling phase transition for single-layer MTe2 (M = Mo and W): modulation of the potential barrier under strainElectronic supplementary information (ESI) available: Calculations of the effect of changes in lattice parameters on the energy barrier, changes in lattice parameters along the c-axis in the process of phase trantion from 2H to 1T′, the effect of a-axis compression under the b-axis tensile strain for MoTe2 and the effect of a-axis expansion under b-axis compressive strain for WTe2. See DOI: 10.1039/c5cp06706eFan, Xiaofeng et al. | 2016
- 3363
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Front cover| 2016
- 3364
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Inside front cover| 2016
- 3365
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Contents list| 2016
- 3392
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Ordered ionic liquid structure observed at terraced graphite interfacesHe, Xing / Wu, Chengyi / Rajagopal, Karjini et al. | 2016
- 3397
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Self-propelled two dimensional polymer multilayer plate micromotorsGai, Meiyu / Frueh, Johanne / Hu, Narisu et al. | 2016
- 3402
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Formation of GaP nanocones and micro-mesas by metal-assisted chemical etchingKim, Jaehoon / Oh, Jihun et al. | 2016
- 3409
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Effect of band structure on the hot-electron transfer over Au photosensitized brookite TiO2Zhao, Ming / Xu, Hua / Ouyang, Shuxin et al. | 2016
- 3413
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Graphene-catalyzed photoreduction of dye molecules revealed by graphene enhanced Raman spectroscopyLee, Bora / Kang, Jin Hyoun / Jo, Insu et al. | 2016
- 3416
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Initial stages of water solvation of stepped platinum surfacesKolb, Manuel J. / Wermink, Jasper / Calle-Vallejo, Federico et al. | 2016
- 3416
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Initial stages of water solvation of stepped platinum surfacesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp04468eJuurlink, Ludo B. F et al. | 2016
- 3423
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The elastic–plastic transition in nanoparticle collisionsMillán, Emmanuel N. / Tramontina, Diego R. / Urbassek, Herbert M. et al. | 2016
- 3430
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A new medium for triplet–triplet annihilated upconversion and photocatalytic applicationYe, Changqing / Wang, Jingjing / Wang, Xiaomei et al. | 2016
- 3438
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Squaraine based solution processed inverted bulk heterojunction solar cells processed in airVarma, P. C. Reshmi / Namboothiry, Manoj A. G. et al. | 2016
- 3444
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Scope of negative solvatochromism and solvatofluorochromism of merocyaninesKulinich, A. V. / Mikitenko, E. K. / Ishchenko, A. A. et al. | 2016
- 3454
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Electronic structure of the para-benzoquinone radical anion revisitedKunitsa, Alexander A. / Bravaya, Ksenia B. et al. | 2016
- 3463
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Inverted hybrid CdSe-polymer solar cells adopting PEDOT:PSS/MoO3 as dual hole transport layersElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06677hYu, Qiuming et al. | 2016
- 3463
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Inverted hybrid CdSe–polymer solar cells adopting PEDOT:PSS/MoO3 as dual hole transport layersZhu, Leize / Richardson, Beau J. / Yu, Qiuming et al. | 2016
- 3472
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A comparison of the abilities of natural rubber (NR) and synthetic polyisoprene cis-1,4 rubber (IR) to crystallize under strain at high strain ratesCandau, Nicola / Chazeau, Laurent / Chenal, Jean-Marc et al. | 2016
- 3482
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Introduction of carbon nano-tubes into the phosphor to restrain the saturation behavior in low voltage cathodoluminescenceShang, Chunyu / Zhao, Jinxian / Wang, Xiuqin et al. | 2016
- 3489
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Laboratory astrochemistry: catalytic conversion of acetylene to polycyclic aromatic hydrocarbons over SiC grainsZhao, T. Q. / Li, Q. / Liu, B. S. et al. | 2016
- 3497
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Enhanced cation recognition by a macrocyclic ionophore at the air–solution interface probed by mass spectrometryRodrigo, Francisco / Gámez, Francisco / Avilés-Moreno, Juan R. et al. | 2016
- 3504
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Assembly of polyaniline nanotubes by interfacial polymerization for corrosion protectionOueiny, C. / Berlioz, S. / Perrin, F. X. et al. | 2016
- 3510
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Molecular dynamics of the Bacillus subtilis expansin EXLX1: interaction with substrates and structural basis of the lack of activity of mutantsSilveira, Rodrigo L. / Skaf, Munir S. et al. | 2016
- 3522
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Ablation dynamics of Co/ZnS targets under double pulse femtosecond laser irradiationLopez-Quintas, Ignacio / Loriot, Vincent / Ávila, David et al. | 2016
- 3530
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Evaluating bulk Nb2O2F3 for Li-battery electrode applicationsAraujo, Rafael B. / Ahuja, Rajeev et al. | 2016
- 3536
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Molecular mechanism investigation of the neutralization of cadmium toxicity by transferrinWang, Jing / Wang, Jinhu / Song, Wei et al. | 2016
- 3545
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An extended DFTB-CI model for charge-transfer excited states in cationic molecular clusters: model studies versus ab initio calculations in small PAH clustersDontot, Léo / Suaud, Nicola / Rapacioli, Mathia et al. | 2016
- 3558
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Dependence of cobaltocenium diffusion in ionic liquids on the alkyl chain length of 1-alkyl-3-methylimidazolium cationsElectronic supplementary information (ESI) available: Supporting figures and tables. See DOI: 10.1039/c5cp06542aNishiyama, Katsuhiko et al. | 2016
- 3558
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Dependence of cobaltocenium diffusion in ionic liquids on the alkyl chain length of 1-alkyl-3-methylimidazolium cationsUeda, Hiroyuki / Nishiyama, Katsuhiko / Yoshimoto, Soichiro et al. | 2016
- 3567
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A kinetic study on the reduction of CO2 by frustrated Lewis pairs: from understanding to rational designLiu, Lei / Vankova, Nina / Heine, Thoma et al. | 2016
- 3567
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A kinetic study on the reduction of CO2 by frustrated Lewis pairs: from understanding to rational designElectronic supplementary information (ESI) available: All cartesian coordinates of the stationary points along the reaction path, including local minima and transition states. This material is available free of charge on the RSC publication website. See DOI: 10.1039/c5cp06925dLiu, Lei et al. | 2016
- 3575
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Phosphorescence quenching of fac-tris(2-phenylpyridyl)iridium(iii) complexes in thin films on dielectric surfacesRibierre, J. C. / Ruseckas, A. / Staton, S. V. et al. | 2016
- 3581
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Comparison of p-hole tetrel bonding with -hole halogen bonds in complexes of XCN (X = F, Cl, Br, I) and NH3Nziko, V. / Scheiner, S. et al. | 2016
- 3581
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Comparison of π-hole tetrel bonding with σ-hole halogen bonds in complexes of XCN (X = F, Cl, Br, I) and NH3Nziko, Vincent de Paul N. / Scheiner, Steve et al. | 2016
- 3591
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Sensing the quantum behaviour of magnetic nanoparticles by electron magnetic resonanceFittipaldi, M. / Mercatelli, R. / Sottini, S. et al. | 2016
- 3598
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Charge separation and charge recombination photophysical studies in a series of perylene–C60 linear and cyclic dyadsPla, S. / Niemi, M. / Martín-Gomis, L. et al. | 2016
- 3618
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Electronic structure modification and Fermi level shifting in niobium-doped anatase titanium dioxide thin films: a comparative study of NEXAFS, work function and stiffening of phononsGautam, Subodh K. / Das, Arkaprava / Ojha, S. et al. | 2016
- 3628
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Probing the early stages of solvation of cis-pinate dianions by water, acetonitrile, and methanol: a photoelectron spectroscopy and theoretical studyHou, Gao-Lei / Kong, Xiang-Tao / Valiev, Marat et al. | 2016
- 3628
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Probing the early stages of solvation of cis-pinate dianions by water, acetonitrile, and methanol: a photoelectron spectroscopy and theoretical studyElectronic supplementary information (ESI) available: The 20 K photoelectron spectrum of bare cis-PA2− at 266 nm (Fig. S1); a comparison of experimental VDE value with calculated ones for the bare cis-PA2− dianion at different theoretical levels (Table S1); a comparison of experimental VDEs to calculated ones and the relative energies (ΔE) of different isomers for the solvated cis-PA2− clusters at different theoretical levels (Table S2); and Cartesian coordinates and energies of all isomers. See DOI: 10.1039/c5cp05974gKong, Xiang-Tao et al. | 2016
- 3638
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Assembly of Ag3PO4 nanoparticles on two-dimensional Ag2S sheets as visible-light-driven photocatalystsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp04585aWang, Hao et al. | 2016
- 3638
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Assembly of Ag3PO4 nanoparticles on two-dimensional Ag2S sheets as visible-light-driven photocatalystsMa, Peiyan / Yu, Hongjian / Yu, Yong et al. | 2016
- 3644
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Theoretical insights into the photo-protective mechanisms of natural biological sunscreens: building blocks of eumelanin and pheomelaninMarchetti, Barbara / Karsili, Tolga N. V. et al. | 2016
- 3659
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Unravelling the hydrogen absorption process in Pd overlayers on a Au(111) surfaceQuaino, Paola M. / Nazmutdinov, Renat / Peiretti, Leonardo F. et al. | 2016
- 3659
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Unravelling the hydrogen absorption process in Pd overlayers on a Au(111) surfaceElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06443kSantos, Elizabeth et al. | 2016
- 3669
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Prediction of topological phase transition in X2–SiGe monolayersJuarez-Mosqueda, Rosalba / Ma, Yandong / Heine, Thoma et al. | 2016
- 3669
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Prediction of topological phase transition in X2-SiGe monolayersElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06527eHeine, Thomas et al. | 2016
- 3675
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Static and dynamic electronic characterization of organic monolayers grafted on a silicon surfacePluchery, O. / Zhang, Y. / Benbalagh, R. et al. | 2016
- 3675
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Static and dynamic electronic characterization of organic monolayers grafted on a silicon surfaceElectronic supplementary information (ESI) available: Chemical preparation of the GOMs and of the gold nanoparticles, other STM and c-AFM images, calculation of the surface sensitivity of XPS, XPS Au 4f core-level spectra, additional UPS spectra, useful parameters for band bending calculations. See DOI: 10.1039/c5cp05943gGallet, J. J et al. | 2016
- 3685
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Cyclodextrin induced controlled delivery of a biological photosensitizer from a nanocarrier to DNAKundu, Pronab / Ghosh, Saptarshi / Das, Sinjan et al. | 2016
- 3685
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Cyclodextrin induced controlled delivery of a biological photosensitizer from a nanocarrier to DNAElectronic supplementary information (ESI) available: The absorption spectra of PSF in STS and DNA, the plot for the determination of the binding constant of PSF with STS, the plot for the determination of the aggregation number of STS, the plot for the determination of the binding constant of PSF with DNA, the emission spectra of micelle bound PSF with increasing BSA concentration, the emission spectra of micelle bound PSF with increasing β-CD concentration, normalized emission spectra of PSF in various media and variation of the average fluorescence lifetime of micelle bound PSF with increasing β-CD concentration in the presence of ctDNA. See DOI: 10.1039/c5cp06174aKundu, Pronab et al. | 2016
- 3694
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Charge- and thickness-dependent inplane deformation of multilayer graphene thin filmsSun, Sheng / Zhang, Tong-Yi et al. | 2016
- 3700
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Probing the interactions of phenol with oxygenated functional groups on curved fullerene-like sheets in activated carbonYin, Chun-Yang / Ng, Man-Fai / Goh, Bee-Min et al. | 2016
- 3716
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Ammonia-modified Co(ii) sites in zeolites: spin and electron density redistribution through the CoII–NO bondStępniewski, Adam / Radoń, Mariusz / Góra-Marek, Kinga et al. | 2016
- 3716
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Ammonia-modified Co(ii) sites in zeolites: spin and electron density redistribution through the CoII-NO bondElectronic supplementary information (ESI) available: Details of periodic and extended cluster models, CCSD(T) and CASSCF calculations, VB-like analysis of CASSCF wave function, and additional computational results. See DOI: 10.1039/c5cp07452eRado, Mariusz et al. | 2016
- 3730
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Structure and dynamics of the aliphatic cholesterol side chain in membranes as studied by 2H NMR spectroscopy and molecular dynamics simulationVogel, Alexander / Scheidt, Holger A. / Baek, Dong Jae et al. | 2016
- 3739
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The donor OH stretching–libration dynamics of hydrogen-bonded methanol dimers in cryogenic matricesHeger, M. / Andersen, J. / Suhm, M. A. et al. | 2016
- 3746
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Carbon dioxide induced bubble formation in a CH4–CO2–H2O ternary system: a molecular dynamics simulation studySujith, K. S. / Ramachandran, C. N. et al. | 2016
- 3755
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Electron stimulated hydroxylation of a metal supported silicate filmYu, Xin / Emmez, Emre / Pan, Qiushi et al. | 2016
- 3765
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Theoretical study of electron tunneling through the spiral molecule junctions along spiral pathsXu, Xiaodong / Li, Weiqi / Zhou, Xin et al. | 2016
- 3772
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Two-dimensional infrared spectroscopy of neat ice IhShi, Liang / Skinner, J. L. / Jansen, Thomas L. C. et al. | 2016
- 3780
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High-performance lithium storage in an ultrafine manganese fluoride nanorod anode with enhanced electrochemical activation based on conversion reactionRui, Kun / Wen, Zhaoyin / Huang, Xiao et al. | 2016
- 3788
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Augmented Z scheme blueprint for efficient solar water splitting system using quaternary chalcogenide absorber materialSarswat, Prashant K. / Bhattacharyya, Dhiman / Free, Michael L. et al. | 2016
- 3812
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A ladder network modelling the electrochemical impedance of the diffusion and reaction processes in semi-infinite spaceMoya, A. A. et al. | 2016
- 3817
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Free volumes and gas transport in polymers: amine-modified epoxy resins as a case studyPatil, Pushkar N. / Roilo, David / Brusa, Roberto S. et al. | 2016
- 3825
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Temperature-resolved optical spectroscopy of pentacene polymorphs: variation of herringbone angles in single-crystals and interface-controlled thin filmsMeyenburg, Ingo / Breuer, Tobia / Karthäuser, Andrea et al. | 2016
- 3832
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Photonic vortices induced in a single-component phototropic liquid crystalDradrach, K. / Bartkiewicz, S. / Miniewicz, A. et al. | 2016
- 3838
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Ultrafast carrier dynamics of carbon nanodots in different pH environmentsSui, Laizhi / Jin, Wuwei / Li, Suyu et al. | 2016
- 3846
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Solution growth of Ta-doped hematite nanorods for efficient photoelectrochemical water splitting: a tradeoff between electronic structure and nanostructure evolutionFu, Yanming / Dong, Chung-Li / Zhou, Zhaohui et al. | 2016
- 3854
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Interaction of a conjugated polyaromatic molecule with a single dangling bond quantum dot on a hydrogenated semiconductorGodlewski, Szymon / Kolmer, Marek / Engelund, Mad et al. | 2016
- 3862
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Atomic scale insights into urea–peptide interactions in solutionSteinke, Nicola / Gillams, Richard J. / Pardo, Luis Carlo et al. | 2016
- 3871
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Direct observation of structural properties and fluorescent trapping sites in macrocyclic porphyrin arrays at the single-molecule levelHam, Sujin / Lee, Ji-Eun / Song, Suhwan et al. | 2016
- 3878
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Plasmonic properties of Ag nanoparticles embedded in GeO2–SiO2 matrix by atom beam sputteringMohapatra, Satyabrata et al. | 2016
- 3884
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The effect of junction modes between backbones and side chains of polyimides on the stability of liquid crystal vertical alignmentChe, Xinyuan / Gong, Shiming / Zhang, Heng et al. | 2016
- 3893
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Growth of 3D hierarchical porous NiO@carbon nanoflakes on graphene sheets for high-performance lithium-ion batteriesWang, Xiongwei / Zhang, Ludan / Zhang, Zehui et al. | 2016
- 3900
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High temperature oxidation of iron–iron oxide core–shell nanowires composed of iron nanoparticlesKrajewski, M. / Brzozka, K. / Lin, W. S. et al. | 2016
- 3910
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A new potassium-based intermediate and its role in the desorption properties of the K–Mg–N–H systemSantoru, A. / Garroni, S. / Pistidda, C. et al. | 2016
- 3921
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Metal free earth abundant elemental red phosphorus: a new class of visible light photocatalyst and photoelectrode materialsAnsari, Sajid Ali / Ansari, Mohammad Shahnawaze / Cho, Moo Hwan et al. | 2016
- 3929
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A mixed iron–manganese based pyrophosphate cathode, Na2Fe0.5Mn0.5P2O7, for rechargeable sodium ion batteriesShakoor, Rana A. / Park, Chan Sun / Raja, Arsalan A. et al. | 2016
- 3936
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Where does methanol lose hydrogen to trigger steam reforming? A revisit of methanol dehydrogenation on the PdZn alloy model obtained from kinetic Monte Carlo simulationsCheng, Feng / Chen, Zhao-Xu et al. | 2016
- 3944
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Emission shaping in fluorescent proteins: role of electrostatics and π-stackingPark, Jae Woo / Rhee, Young Min et al. | 2016
- 3944
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Emission shaping in fluorescent proteins: role of electrostatics and p-stackingPark, J. / Rhee, Y. et al. | 2016
- 3956
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The truth about the 1st cycle Coulombic efficiency of LiNi1/3Co1/3Mn1/3O2 (NCM) cathodesKasnatscheew, J. / Evertz, M. / Streipert, B. et al. | 2016
- 3966
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Potential energy surface of fluoroxene: experiment and theoryUriarte, Iciar / Écija, Patricia / Spada, Lorenzo et al. | 2016
- 3975
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A robust comparison of dynamical scenarios in a glass-forming liquidVispa, Alessandro / Busch, Sebastian / Tamarit, Josep Llui et al. | 2016
- 3982
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Copper(ii) complexes with peptides based on the second cell binding site of fibronectin: metal coordination and ligand exchange kineticsPizzanelli, Silvia / Forte, Claudia / Pinzino, Calogero et al. | 2016
- 3995
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Designing voltage multipliers with nanofluidic diodes immersed in aqueous salt solutionsRamirez, P. / Gomez, V. / Verdia-Baguena, C. et al. | 2016
- 4000
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Chemical bonding-induced rich electronic properties of oxygen adsorbed few-layer graphenesThuy Tran, Ngoc Thanh / Lin, Shih-Yang / Lin, Yu-Tsung et al. | 2016
- 4019
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The formation of heterointerface defects in Au/Cu films on Si substrates under direct current in a vacuum ultraviolet environmentYan, Kai / Yao, Wenqing / Yang, Liping et al. | 2016
- 4026
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Efficient electron-promoted desorption of benzene from water ice surfacesMarchione, Demian / Thrower, John D. / McCoustra, Martin R. S. et al. | 2016
- 4035
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Improving dipolar recoupling for site-specific structural and dynamics studies in biosolids NMR: windowed RN-symmetry sequencesLu, Xingyu / Zhang, Huilan / Lu, Manman et al. | 2016
- 4045
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Charge transport dependent high open circuit voltage tandem organic photovoltaic cells with low temperature deposited HATCN-based charge recombination layersWei, Huai-Xin / Zu, Feng-Shuo / Li, Yan-Qing et al. | 2016
- 4051
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Computational methods for the description of pharmacologically relevant platinum complexes – molecular structure and bond dissociationKokoschka, Malte / Galgonek, Jakub / Vondrasek, Jiri et al. | 2016
- 4063
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σ Bond activation through tunneling: formation of the boron hydride cations BHn+ (n = 2, 4, 6)Qiu, Yudong / Wu, Chia-Hua / Schaefer III, Henry F. et al. | 2016
- 4071
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Deuteron NMR resolved mesogen vs. crosslinker molecular order and reorientational exchange in liquid single crystal elastomersMilavec, J. / Domenici, V. / Zupančič, B. et al. | 2016
- 4086
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Controlling phase transition for single-layer MTe2 (M = Mo and W): modulation of the potential barrier under strainHuang, H. H. / Fan, Xiaofeng / Singh, David J. et al. | 2016
- 4095
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Shrimp-shell derived carbon nanodots as carbon and nitrogen sources to fabricate three-dimensional N-doped porous carbon electrocatalysts for the oxygen reduction reactionLiu, Rongrong / Zhang, Haimin / Liu, Shengwen et al. | 2016
- 4112
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Adsorption and separation of binary and ternary mixtures of SO2, CO2 and N2 by ordered carbon nanotube arrays: grand-canonical Monte Carlo simulationsRahimi, Mahshid / Singh, Jayant K. / Müller-Plathe, Florian et al. | 2016
- 4121
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Plasmon resonances tailored by Fano profiles in silver-based core–shell nanoparticlesPellarin, Michel / Broyer, Michel / Lermé, Jean et al. | 2016
- 4121
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Plasmon resonances tailored by Fano profiles in silver-based core-shell nanoparticlesElectronic supplementary information (ESI) available: (1) Parameterization of an effective dielectric function for coinage metals (Fig. SI1, SI2, SI3 and Table SI1 for adjusted parameters). (2) Theoretical description of the surface plasmon resonance of single nanospheres and nanoshells. (3) LSPR versus IB transitions in silver nanospheres (Fig. SI4). (4) LSPR of a nickel nanosphere and nanoshell (Fig. SI5). (5) Polarizability of a silver nanosphere in the dipolar approximation (Fig. SI6). (6) Compared optical responses of Au@Cu and Cu@Au core-shell nanoparticles (Fig. SI7). (7) Compared optical response of Cu@Ag and Ag@Cu nanoparticles of various compositions (Fig. SI8). (8) Compared optical response of Ni@Ag and Ni@Au nanoparticles (Fig. SI9). See DOI: 10.1039/c5cp07113ePellarin, Michel et al. | 2016
- 4134
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Excited-state localization and energy transfer in pyrene core dendrimers with fluorene/carbazole as the dendrons and acetylene as the linkagesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07384gWan, Yan et al. | 2016
- 4134
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Excited-state localization and energy transfer in pyrene core dendrimers with fluorene/carbazole as the dendrons and acetylene as the linkagesYan, Linyin / Wan, Yan / Xia, Andong et al. | 2016
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Reaction mechanism of a PbS-on-ZnO heterostructure and enhanced photovoltaic diode performance with an interface-modulated heterojunction energy band structureLi, Haili / Jiao, Shujie / Ren, Jinxian et al. | 2016
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Reaction mechanism of a PbS-on-ZnO heterostructure and enhanced photovoltaic diode performance with an interface-modulated heterojunction energy band structureElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06150dRen, Jinxian et al. | 2016
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Evaluation of the electronic properties of perfluorophenyl functionalized quinolines and their hybrids with carbon nanostructuresSygellou, Lambrini / Kakogianni, Sofia / Andreopoulou, Aikaterini K. et al. | 2016
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Nanoporous PdCr alloys as highly active electrocatalysts for oxygen reduction reactionDuan, Huimei / Xu, Caixia et al. | 2016
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Nanoporous PdCr alloys as highly active electrocatalysts for oxygen reduction reactionElectronic supplementary information (ESI) available: EDS data for the PdCrAl precursor and the resulting NP-Pd75Cr25 sample, the SEM image and high-resolution EDS elemental maps of the NP-Pd75Cr25 alloy, the SEM image of the NP-Pd67Cr33 alloy, pore size distribution of the NP-Pd75Cr25 alloy, CV curves of all catalysts before and after 600 and 1000 potential cycles at potentials from 0 to 1.4 V, and the TEM image of the NP-Pd75Cr25 alloy upon stability testing. See DOI: 10.1039/c5cp07184dXu, Caixia et al. | 2016
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Three-photon circular dichroism: towards a generalization of chiroptical non-linear light absorptionFriese, Daniel H. / Ruud, Kenneth et al. | 2016
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Three-photon circular dichroism: towards a generalization of chiroptical non-linear light absorptionElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07102jRuud, Kenneth et al. | 2016
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Stabilities and defect-mediated lithium-ion conduction in a ground state cubic Li3N structureNguyen, Manh Cuong / Hoang, Khang / Wang, Cai-Zhuang et al. | 2016
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LiCl solvation in N-methyl-acetamide (NMA) as a model for understanding Li+ binding to an amide planeManin, Nikolai / da Silva, Mauricio C. / Zdravkovic, Igor et al. | 2016
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Comment on “Fullerene-based materials for solar cell applications: design of novel acceptors for efficient polymer solar cells – a DFT study” by A. Mohajeri and A. Omidvar, Phys. Chem. Chem. Phys., 2015, 17, 22367Sabirov, Denis Sh. / Terentyev, Anton O. / Shepelevich, Igor S. et al. | 2016
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Reply to the ‘Comment on “Fullerene-based materials for solar cell applications: design of novel acceptors for efficient polymer solar cells – a DFT study”’ by D. S. Sabirov, A. O. Terentyev and I. S. Shepelevich, Phys. Chem. Chem. Phys., 2016, DOI: 10.1039/C5CP05408GMohajeri, Afshan / Omidvar, Akbar et al. | 2016
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Correction: Singlet lifetime measurements in an all-proton chemically equivalent spin system by hyperpolarization and weak spin lock transfersZhang, Y. / Basu, K. / Canary, J. W. et al. | 2016
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Inside back cover| 2016
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Back cover| 2016
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Shrimp-shell derived carbon nanodots as carbon and nitrogen sources to fabricate three-dimensional N-doped porous carbon electrocatalysts for the oxygen reduction reactionElectronic supplementary information (ESI) available: SEM images of SiO2 spheres, SEM images of NPC-500, NPC-600, NPC-700, NPC-900 and NC-800, surface survey XPS spectra and high resolution C 1s spectra of NPC-500, NPC-800 and NPC-900, and electrochemical measurements of NPC-500, NPC-600, NPC-700 and NPC-900. See DOI: 10.1039/c5cp06970jZhao, Huijun et al. | 2016
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Charge separation and charge recombination photophysical studies in a series of perylene-C60 linear and cyclic dyadsElectronic supplementary information (ESI) available: Spectral data of new described compounds. See DOI: 10.1039/c5cp06340jPla, S et al. | 2016
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Self-propelled two dimensional polymer multilayer plate micromotorsElectronic supplementary information (ESI) available: Materials and methods, Videos. See DOI: 10.1039/c5cp07697hSukhorukov, Gleb B et al. | 2016
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LiCl solvation in N-methyl-acetamide (NMA) as a model for understanding Li+ binding to an amide planeElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp04847hManin, Nikolai et al. | 2016
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Comparison of π-hole tetrel bonding with σ-hole halogen bonds in complexes of XCN (X = F, Cl, Br, I) and NH3Electronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07545aNziko, Vincent de Paul N et al. | 2016
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σ Bond activation through tunneling: formation of the boron hydride cations BHn+ (n = 2, 4, 6)Electronic supplementary information (ESI) available. See DOI: 10.1039/c5cp05505aWu, Chia-Hua et al. | 2016