PHYSICAL CHEMISTRY CHEMICAL PHYSICS -CAMBRIDGE- ROYAL SOCIETY OF CHEMISTRY
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Table of contents
- 2917
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Front cover| 2018
- 2918
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Inside front cover| 2018
- 2919
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Contents list| 2018
- 2945
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Complex molecular systems: a frontier of molecular scienceTahara, Tahei / Kitao, Akio / Mizutani, Yasuhisa et al. | 2018
- 2947
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Multiscale methods framework: self-consistent coupling of molecular theory of solvation with quantum chemistry, molecular simulations, and dissipative particle dynamicsKovalenko, Andriy / Gusarov, Sergey et al. | 2018
- 2970
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The effect of regioisomerism on the photophysical properties of alkylated-naphthalene liquidsNarayan, B. / Nagura, K. / Takaya, T. et al. | 2018
- 2976
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The C-terminal cytidine deaminase domain of APOBEC3G itself undergoes intersegmental transfer for a target search, as revealed by real-time NMR monitoringKamba, Keisuke / Nagata, Takashi / Katahira, Masato et al. | 2018
- 2982
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The first successful observation of in-cell NMR signals of DNA and RNA in living human cellsYamaoki, Yudai / Kiyoishi, Ayaka / Miyake, Masayuki et al. | 2018
- 2986
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Structure of in cell protein crystals containing organometallic complexesAbe, Satoshi / Atsumi, Kohei / Yamashita, Keitaro et al. | 2018
- 2990
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Origins of biological function in DNA and RNA hairpin loop motifs from replica exchange molecular dynamics simulationSwadling, Jacob B. / Ishii, Kunihiko / Tahara, Tahei et al. | 2018
- 3002
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Structure at the air/water interface in the presence of phenol: a study using heterodyne-detected vibrational sum frequency generation and molecular dynamics simulationKusaka, Ryoji / Ishiyama, Tatsuya / Nihonyanagi, Satoshi et al. | 2018
- 3010
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Rate constants, processivity, and productive binding ratio of chitinase A revealed by single-molecule analysisNakamura, Akihiko / Tasaki, Tomoyuki / Okuni, Yasuko et al. | 2018
- 3019
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Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structuresMochida, Tomoyuki / Ishida, Mai / Tominaga, Takumi et al. | 2018
- 3029
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Intermolecular charge fluxes and far-infrared spectral intensities of liquid formamideTorii, Hajime et al. | 2018
- 3040
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Effects of third-order susceptibility in sum frequency generation spectra: a molecular dynamics study in liquid waterJoutsuka, Tatsuya / Hirano, Tomonori / Sprik, Michiel et al. | 2018
- 3054
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Effect of ligand binding on a protein with a complex folding landscapeMazal, Hisham / Aviram, Haim / Riven, Inbal et al. | 2018
- 3063
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Single-component supported lipid bilayers probed using broadband nonlinear opticsOlenick, Laura L. / Chase, Hilary M. / Fu, Li et al. | 2018
- 3073
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Molecular rotors confined at an ordered 2D interfaceMori, Taizo / Komatsu, Hirokazu / Sakamoto, Naoki et al. | 2018
- 3079
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Real-time observation of the photoionization-induced water rearrangement dynamics in the 5-hydroxyindole–water cluster by time-resolved IR spectroscopyMiyazaki, Mitsuhiko / Naito, Ayumi / Ikeda, Takamasa et al. | 2018
- 3092
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Sequential microhydration of cationic 5-hydroxyindole (5HI+): infrared photodissociation spectra of 5HI+-Wn clusters (W = H2O, n<= 4)Klyne, J. / Miyazaki, M. / Fujii, M. et al. | 2018
- 3092
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Sequential microhydration of cationic 5-hydroxyindole (5HI+): infrared photodissociation spectra of 5HI+–Wn clusters (W = H2O, n ≤ 4)Klyne, Johanna / Miyazaki, Mitsuhiko / Fujii, Masaaki et al. | 2018
- 3109
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Influence of the DNA sequence/length and pH on deaminase activity, as well as the roles of the amino acid residues around the catalytic center of APOBEC3FWan, Li / Nagata, Takashi / Katahira, Masato et al. | 2018
- 3118
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Solvate and protic ionic liquids from aza-crown ethers: synthesis, thermal properties, and LCST behaviorOba, Yukiko / Okuhata, Megumi / Osakai, Toshiyuki et al. | 2018
- 3128
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Protonation/reduction dynamics at the [4Fe–4S] cluster of the hydrogen-forming cofactor in [FeFe]-hydrogenasesSenger, Moritz / Mebs, Stefan / Duan, Jifu et al. | 2018
- 3141
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Solid state vibrational circular dichroism towards molecular recognition: chiral metal complexes intercalated in a clay mineralSato, Hisako / Tamura, Kenji / Takimoto, Kazuyoshi et al. | 2018
- 3148
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Stepwise microhydration of aromatic amide cations: water solvation networks revealed by the infrared spectra of acetanilide+-(H2O)n clusters (n<= 3)Klyne, J. / Schmies, M. / Miyazaki, M. et al. | 2018
- 3148
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Stepwise microhydration of aromatic amide cations: water solvation networks revealed by the infrared spectra of acetanilide+–(H2O)n clusters (n ≤ 3)Klyne, Johanna / Schmies, Matthia / Miyazaki, Mitsuhiko et al. | 2018
- 3165
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Low-temperature FTIR spectroscopy provides evidence for protein-bound water molecules in eubacterial light-driven ion pumpsNomura, Yurika / Ito, Shota / Teranishi, Miwako et al. | 2018
- 3172
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Spectroscopic characteristics of Rubricoccus marinus xenorhodopsin (RmXeR) and a putative model for its inward H+ transport mechanismInoue, Saki / Yoshizawa, Susumu / Nakajima, Yu et al. | 2018
- 3184
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Molecular details of the unique mechanism of chloride transport by a cyanobacterial rhodopsinHarris, Andrew / Saita, Mattia / Resler, Tom et al. | 2018
- 3200
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Successive energy transfer within multiple photosensitizers assembled in a hexameric hemoprotein scaffoldMashima, Tsuyoshi / Oohora, Koji / Hayashi, Takashi et al. | 2018
- 3210
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Stereochemical effects on dynamics in two-component systems of gelators with perfluoroalkyl and alkyl chains as revealed by vibrational circular dichroismSato, Hisako / Yajima, Tomoko / Yamagishi, Akihiko et al. | 2018
- 3216
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Site-specific time-resolved FRET reveals local variations in the unfolding mechanism in an apparently two-state protein unfolding transitionBhatia, Sandhya / Krishnamoorthy, G. / Udgaonkar, Jayant B. et al. | 2018
- 3233
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Two-dimensional structural ordering in a chromophoric ionic liquid for triplet energy migration-based photon upconversionHisamitsu, Shota / Yanai, Nobuhiro / Kouno, Hironori et al. | 2018
- 3241
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Oxygen induced enhancement of NIR emission in brookite TiO2 powders: comparison with rutile and anatase TiO2 powdersVequizo, Junie Jhon M. / Kamimura, Sunao / Ohno, Teruhisa et al. | 2018
- 3249
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The critical role of dimer formation in monosaccharides binding to human serum albuminPongprayoon, Prapasiri / Mori, Toshifumi et al. | 2018
- 3258
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Experimental and theoretical investigation of fluorescence solvatochromism of dialkoxyphenyl-pyrene moleculesLu, Fengniu / Kitamura, Naoki / Takaya, Tomohisa et al. | 2018
- 3265
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A theoretical study on the size-dependence of ground-state proton transfer in phenol–ammonia clustersShimizu, Toshihiko / Hashimoto, Kenro / Hada, Masahiko et al. | 2018
- 3277
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Microsecond resolved single-molecule FRET time series measurements based on the line confocal optical system combined with hybrid photodetectorsOikawa, Hiroyuki / Takahashi, Takumi / Kamonprasertsuk, Supawich et al. | 2018
- 3286
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Synthesis and properties of [7]helicene and [7]helicene-like compounds with a cyclopenta[1,2-b:4,3-b′]dithiophene or dithieno[2,3-b:3′,2′-d]heterole skeletonUematsu, K. / Noguchi, K. / Nakano, K. et al. | 2018
- 3286
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Synthesis and properties of [7]helicene and [7]helicene-like compounds with a cyclopenta[1,2-b:4,3-bprime]dithiophene or dithieno[2,3-b:3prime,2prime-d]heterole skeletonUematsu, K. / Noguchi, K. / Nakano, K. et al. | 2018
- 3296
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Fundamental peak disappears upon binding of a noble gas: a case of the vibrational spectrum of PtCO in an argon matrixOno, Yuriko / Yagi, Kiyoshi / Takayanagi, Toshiyuki et al. | 2018
- 3303
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Visualizing rotational wave functions of electronically excited nitric oxide molecules by using an ion imaging techniqueMizuse, Kenta / Chizuwa, Nao / Ikeda, Dai et al. | 2018
- 3310
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Excited state energy fluctuations in the Fenna–Matthews–Olson complex from molecular dynamics simulations with interpolated chromophore potentialsKim, Chang Woo / Choi, Bongsik / Rhee, Young Min et al. | 2018
- 3320
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Vibrational relaxation dynamics of b-carotene and its derivatives with substituents on terminal rings in electronically excited states as studied by femtosecond time-resolved stimulated Raman spectroscopy in the near-IR regionTakaya, T. / Anan, M. / Iwata, K. et al. | 2018
- 3320
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Vibrational relaxation dynamics of β-carotene and its derivatives with substituents on terminal rings in electronically excited states as studied by femtosecond time-resolved stimulated Raman spectroscopy in the near-IR regionTakaya, Tomohisa / Anan, Masato / Iwata, Koichi et al. | 2018
- 3328
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Computational study on the luminescence quantum yields of terbium complexes with 2,2prime-bipyridine derivative ligandsHatanaka, M. / Osawa, A. / Wakabayashi, T. et al. | 2018
- 3328
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Computational study on the luminescence quantum yields of terbium complexes with 2,2′-bipyridine derivative ligandsHatanaka, Miho / Osawa, Ayato / Wakabayashi, Tomonari et al. | 2018
- 3334
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Structure and dynamics of solvent molecules inside the polytheonamide B channel in different environments: a molecular dynamics studyKalathingal, Mahroof / Sumikama, Takashi / Mori, Toshifumi et al. | 2018
- 3349
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Analysis of the conformational properties of amine ligands at the gold/water interface with QM, MM and QM/MM simulationsLiang, Dongyue / Hong, Jiewei / Fang, Dong et al. | 2018
- 3363
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Tertiary dynamics of human adult hemoglobin fixed in R and T quaternary structuresChang, Shanyan / Mizuno, Misao / Ishikawa, Haruto et al. | 2018
- 3373
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The aggregation of an alkyl–C60 derivative as a function of concentration, temperature and solvent typeHollamby, Martin J. / Smith, Catherine F. / Britton, Melanie M. et al. | 2018
- 3381
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“In situ” observation of the role of chloride ion binding to monkey green sensitive visual pigment by ATR-FTIR spectroscopyKatayama, Kota / Furutani, Yuji / Iwaki, Masayo et al. | 2018
- 3388
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Structural changes of water molecules during photoelectrochemical water oxidation on TiO2 thin film electrodesRanasinghe, Chandana Sampath Kumara / Yamakata, Akira et al. | 2018
- 3395
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Selective resonance Raman enhancement of large amplitude inter-ring vibrations of [34](1,2,4,5)cyclophane radical cation; a model of p-stacked dimer radical ionsOkajima, H. / Shinmyozu, T. / Sakamoto, A. et al. | 2018
- 3395
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Selective resonance Raman enhancement of large amplitude inter-ring vibrations of [34](1,2,4,5)cyclophane radical cation; a model of π-stacked dimer radical ionsOkajima, Hajime / Shinmyozu, Teruo / Sakamoto, Akira et al. | 2018
- 3403
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Non-invasive force measurement reveals the number of active kinesins on a synaptic vesicle precursor in axonal transport regulated by ARL-8Hayashi, Kumiko / Hasegawa, Shin / Sagawa, Takashi et al. | 2018
- 3411
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On the turn-inducing properties of asparagine: the structuring role of the amide side chain, from isolated model peptides to crystallized proteinsHabka, S. / Sohn, W. Y. / Vaquero-Vara, V. et al. | 2018
- 3424
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Tailoring a nanostructured plasmonic absorber for high efficiency surface-assisted laser desorption/ionizationZhu, Jing-jing / Meng, Xiao / Zhang, Chi et al. | 2018
- 3430
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The photocatalytic role of electrodeposited copper on pencil graphiteP. J., Arathi / Bhaskar, Seemesh / G., Rajendra Kumar Reddy et al. | 2018
- 3433
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Local and global aromaticity in a molecular carbon nanobelt: insights from magnetic response properties in neutral and charged speciesMuñoz-Castro, A. et al. | 2018
- 3438
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Binding affinity prediction of nanobody–protein complexes by scoring of molecular dynamics trajectoriesSoler, Miguel A. / Fortuna, Sara / de Marco, Ario et al. | 2018
- 3445
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Anharmonic vibrational spectra from double incremental potential energy and dipole surfacesMadsen, Diana / Christiansen, Ove / König, Carolin et al. | 2018
- 3457
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N-Doped graphene-supported PdCu nanoalloy as efficient catalyst for reducing Cr(vi) by formic acidLi, Shuangzhi / Liu, Lijun / Zhao, Qing et al. | 2018
- 3465
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Mechanical stability of a nanotube from monolayer black phosphorus with the [110] direction as the tube's circumference or generatrixZhao, Zhiqiang / Yin, Hang / Cai, Kun et al. | 2018
- 3474
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Size-dependent formation of membrane nanotubes: continuum modeling and molecular dynamics simulationsTian, Falin / Yue, Tongtao / Dong, Wei et al. | 2018
- 3484
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Photoexcited charge carrier dynamics of interconnected TiO2 nanoparticles: evidence of enhancement of charge separation at anatase–rutile particle interfacesShingai, Daiki / Ide, Yusuke / Sohn, Woon Yong et al. | 2018
- 3490
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Photodissociation dynamics of bromoiodomethane from the first and second absorption bands. A combined velocity map and slice imaging studyMarggi Poullain, Sonia / Chicharro, David V. / Navarro, Eduardo et al. | 2018
- 3504
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Single Pd atomic catalyst on Mo2CO2 monolayer (MXene): unusual activity for CO oxidation by trimolecular Eley–Rideal mechanismCheng, Cheng / Zhang, Xilin / Wang, Mingyang et al. | 2018
- 3514
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A high pressure study of calmodulin–ligand interactions using small-angle X-ray and elastic incoherent neutron scatteringCinar, Süleyman / Al-Ayoubi, Samy / Sternemann, Christian et al. | 2018
- 3523
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pH-Dependent cooperativity and existence of a dry molten globule in the folding of a miniprotein BBLYue, Zhi / Shen, Jana et al. | 2018
- 3531
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Determination of derived volumetric properties and heat capacities at high pressures using two density scaling based equations of state. Application to dipentaerythritol hexa(3,5,5-trimethylhexanoate)López, E. R. / Fandiño, O. / Cabaleiro, D. et al. | 2018
- 3543
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The structural diversity of C-rich DNA aggregates: unusual self-assembly of beetle-like nanostructuresProtopopova, A. D. / Tsvetkov, V. B. / Varizhuk, A. M. et al. | 2018
- 3554
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Polymerization kinetics of a multi-functional silica precursor studied using a novel Monte Carlo simulation techniqueShere, Inderdip / Malani, Ateeque et al. | 2018
- 3571
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Self-assembly of high-index faceted gold nanocrystals to fabricate tunable coupled plasmonic superlatticesZhang, Haibin / Guan, Chunlin / Song, Ning et al. | 2018
- 3581
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Design of donor–acceptor copolymers for organic photovoltaic materials: a computational studyTuran, Haydar Taylan / Kucur, Oğuzhan / Kahraman, Birce et al. | 2018
- 3592
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Alamethicin self-assembling in lipid membranes: concentration dependence from pulsed EPR of spin labelsSyryamina, Victoria N. / De Zotti, Marta / Toniolo, Claudio et al. | 2018
- 3602
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A DFT study of the adsorption of short peptides on Mg and Mg-based alloy surfacesFang, Zhe / Wang, Jianfeng / Zhu, Shijie et al. | 2018
- 3608
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Tuning the indirect–direct band gap transition in the MoS2−xSex armchair nanotube by diameter modulationWu, Hong-Hui / Meng, Qiangqiang / Huang, He et al. | 2018
- 3614
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Chemical dynamics simulations of CID of peptide ions: comparisons between TIK(H+)2 and TLK(H+)2 fragmentation dynamics, and with thermal simulationsHomayoon, Zahra / Macaluso, Veronica / Martin-Somer, Ana et al. | 2018
- 3630
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A synergic approach of X-ray powder diffraction and Raman spectroscopy for crystal structure determination of 2,3-thienoimide capped oligothiophenesCappuccino, C. / Mazzeo, P. P. / Salzillo, T. et al. | 2018
- 3637
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Central-metal effect on intramolecular vibrational energy transfer of M(CO)5Br (M = Mn, Re) probed by two-dimensional infrared spectroscopyYang, Fan / Dong, Xueqian / Feng, Minjun et al. | 2018
- 3648
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Enhanced photocatalytic efficiency of C3N4/BiFeO3 heterojunctions: the synergistic effects of band alignment and ferroelectricityDeng, Xian-Zhu / Song, Chuang / Tong, Yin-Lin et al. | 2018
- 3658
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Hot kinetic model as a guide to improve organic photovoltaic materialsSosorev, Andrey Yu. / Godovsky, Dmitry Yu. / Paraschuk, Dmitry Yu. et al. | 2018
- 3672
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Water thermophoresis in carbon nanotubes: the interplay between thermophoretic and friction forcesOyarzua, Elton / Walther, Jens H. / Zambrano, Harvey A. et al. | 2018
- 3678
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Magnetism-tuning strategies for graphene oxide based on magnetic oligoacene oxide patches modelWen, Yanjie / Yen, Chia-Liang / Yan, Linyin et al. | 2018
- 3687
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Giant spontaneous exchange bias obtained by tuning magnetic compensation in samarium ferrite single crystalsWang, Xiao-xiong / Gao, Shang / Yan, Xu et al. | 2018
- 3694
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Hierarchical formation of Fe-9eG supramolecular networks via flexible coordination bondsZhang, Chi / Xie, Lei / Ding, Yuanqi et al. | 2018
- 3699
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Energetics and dynamics of the non-natural fluorescent 4AP:DAP base pairChawla, Mohit / Autiero, Ida / Oliva, Romina et al. | 2018
- 3710
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Efficient interfacial charge transfer through plasmon sensitized Ag@Bi2O3 hierarchical photoanodes for photoelectrocatalytic degradation of chlorinated phenolsEswar, Neerugatti KrishnaRao / Adhikari, Sangeeta / Ramamurthy, Praveen C. et al. | 2018
- 3724
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Abnormal separation of the silicon–oxygen bond in the liquid layering transition of silicon dioxide in a nanoslitWang, Zhichao / Li, Tao / Duan, Yunrui et al. | 2018
- 3735
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Effects of particle size and annealing on plasmon-induced charge separation at self-assembled gold nanoparticle arraysKao, Kun-Che / Nishi, Hiroyasu / Tatsuma, Tetsu et al. | 2018
- 3741
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Theoretical investigations on the unsymmetrical effect of β-link Zn–porphyrin sensitizers on the performance for dye-sensitized solar cellsXie, Miao / Bai, Fu-Quan / Wang, Jinjian et al. | 2018
- 3741
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Theoretical investigations on the unsymmetrical effect of b-link Zn-porphyrin sensitizers on the performance for dye-sensitized solar cellsXie, M. / Bai, F. Q. / Wang, J. et al. | 2018
- 3752
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Boundary-induced nucleation control: a theoretical perspectiveBuller, Oleg / Wang, Hong / Wang, Wenchong et al. | 2018
- 3761
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Absolute and relative-rate measurement of the rate coefficient for reaction of perfluoro ethyl vinyl ether (C2F5OCF&z.dbd;CF2) with OHSrinivasulu, G. / Bunkan, A. J. C. / Amedro, D. et al. | 2018
- 3768
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A combined theoretical and experimental investigation on the influence of the bromine substitution pattern on the photophysics of conjugated organic chromophoresMettra, B. / Liao, Y. Y. / Gallavardin, T. et al. | 2018
- 3784
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Theoretical study on the charge transport in single crystals of TCNQ, F2-TCNQ and F4-TCNQJi, Li-Fei / Fan, Jian-Xun / Zhang, Shou-Feng et al. | 2018
- 3795
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Effects of carotenoids on lipid bilayersJohnson, Quentin R. / Mostofian, Barmak / Fuente Gomez, Gabriel et al. | 2018
- 3805
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Large valley polarization in monolayer MoTe2 on a magnetic substrateLi, Ningbo / Zhang, Jiayong / Xue, Yang et al. | 2018
- 3813
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Trends in adsorption of electrocatalytic water splitting intermediates on cubic ABO3 oxidesMontoya, Joseph H. / Doyle, Andrew D. / Nørskov, Jens K. et al. | 2018
- 3819
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On the H2 interactions with transition metal adatoms supported on graphene: a systematic density functional studyManadé, Montserrat / Viñes, Francesc / Gil, Adrià et al. | 2018
- 3831
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A QM/MM and QM/QM/MM study of Kerr, Cotton–Mouton and Jones linear birefringences in liquid acetonitrileFahleson, Tobia / Olsen, Jógvan Magnus Haugaard / Norman, Patrick et al. | 2018
- 3841
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Correction: Escape of anions from geminate recombination in THF due to charge delocalizationChen, Hung-Cheng / Cook, Andrew R. / Asaoka, Sadayuki et al. | 2018
- 3843
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Correction: Model of protocell compartments – dodecyl hydrogen sulfate vesiclesLiu, Bin / Gao, Meihua / Li, Haiping et al. | 2018
- 3844
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Correction: Rate constants, processivity, and productive binding ratio of chitinase A revealed by single-molecule analysisNakamura, Akihiko / Tasaki, Tomoyuki / Okuni, Yasuko et al. | 2018
- 3845
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Correction: Planar vs. three-dimensional X62−, X2Y42−, and X3Y32− (X, Y = B, Al, Ga) metal clusters: an analysis of their relative energies through the turn-upside-down approachEl Bakouri, Ouissam / Solà, Miquel / Poater, Jordi et al. | 2018
- 3847
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Correction: High-temperature X-ray diffraction and thermal expansion of nanocrystalline and coarse-crystalline acanthite α-Ag2S and argentite β-Ag2SSadovnikov, S. I. / Gusev, A. I. / Chukin, A. V. et al. | 2018
- 3847
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Correction: High-temperature X-ray diffraction and thermal expansion of nanocrystalline and coarse-crystalline acanthite a-Ag2S and argentite b-Ag2SSadovnikov, S. I. / Gusev, A. I. / Chukin, A. V. et al. | 2018
- 3851
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Inside back cover| 2018
- 3852
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Back cover| 2018