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Items: 1 to 20 of 844


Machine learning reveals orbital interaction in materials.

Lam Pham T, Kino H, Terakura K, Miyake T, Tsuda K, Takigawa I, Chi Dam H.

Sci Technol Adv Mater. 2017 Oct 26;18(1):756-765. doi: 10.1080/14686996.2017.1378060. eCollection 2017.


Precise control of alloying sites of bimetallic nanoclusters via surface motif exchange reaction.

Yao Q, Feng Y, Fung V, Yu Y, Jiang DE, Yang J, Xie J.

Nat Commun. 2017 Nov 16;8(1):1555. doi: 10.1038/s41467-017-01736-5.


Scaling Relations for Acidity and Reactivity of Zeolites.

Liu C, Tranca I, van Santen RA, Hensen EJM, Pidko EA.

J Phys Chem C Nanomater Interfaces. 2017 Oct 26;121(42):23520-23530. doi: 10.1021/acs.jpcc.7b08176. Epub 2017 Oct 6.


Screening based approach and dehydrogenation kinetics for MgH2: Guide to find suitable dopant using first-principles approach.

Kumar EM, Rajkamal A, Thapa R.

Sci Rep. 2017 Nov 14;7(1):15550. doi: 10.1038/s41598-017-15694-x.


Hidden Magnetic States Emergent Under Electric Field, In A Room Temperature Composite Magnetoelectric Multiferroic.

Clarkson JD, Fina I, Liu ZQ, Lee Y, Kim J, Frontera C, Cordero K, Wisotzki S, Sanchez F, Sort J, Hsu SL, Ko C, Aballe L, Foerster M, Wu J, Christen HM, Heron JT, Schlom DG, Salahuddin S, Kioussis N, Fontcuberta J, Marti X, Ramesh R.

Sci Rep. 2017 Nov 13;7(1):15460. doi: 10.1038/s41598-017-13760-y.


Optically-controlled long-term storage and release of thermal energy in phase-change materials.

Han GGD, Li H, Grossman JC.

Nat Commun. 2017 Nov 13;8(1):1446. doi: 10.1038/s41467-017-01608-y.


Anisotropic attosecond charge carrier dynamics and layer decoupling in quasi-2D layered SnS2.

Eads CN, Bandak D, Neupane MR, Nordlund D, Monti OLA.

Nat Commun. 2017 Nov 8;8(1):1369. doi: 10.1038/s41467-017-01522-3.


Encapsulation of cathode in lithium-sulfur batteries with a novel two-dimensional carbon allotrope: DHP-graphene.

Cai Y, Guo Y, Jiang B, Lv Y.

Sci Rep. 2017 Nov 2;7(1):14948. doi: 10.1038/s41598-017-15010-7.


Design of Reduction Process of SnO2 by CH4 for Efficient Sn Recovery.

Ha H, Yoo M, An H, Shin K, Han T, Sohn Y, Kim S, Lee SR, Han JH, Kim HY.

Sci Rep. 2017 Oct 31;7(1):14427. doi: 10.1038/s41598-017-14826-7.


High potential thermoelectric figure of merit in ternary La3Cu3X4 (X = P, As, Sb and Bi) compounds.

Pandey T, Parker DS.

Sci Rep. 2017 Oct 27;7(1):14270. doi: 10.1038/s41598-017-14658-5.


Tuning methane decomposition on stepped Ni surface: The role of subsurface atoms in catalyst design.

Arevalo RL, Aspera SM, Escaño MCS, Nakanishi H, Kasai H.

Sci Rep. 2017 Oct 25;7(1):13963. doi: 10.1038/s41598-017-14050-3.


Signatures of the topological s +- superconducting order parameter in the type-II Weyl semimetal T d-MoTe2.

Guguchia Z, von Rohr F, Shermadini Z, Lee AT, Banerjee S, Wieteska AR, Marianetti CA, Frandsen BA, Luetkens H, Gong Z, Cheung SC, Baines C, Shengelaya A, Taniashvili G, Pasupathy AN, Morenzoni E, Billinge SJL, Amato A, Cava RJ, Khasanov R, Uemura YJ.

Nat Commun. 2017 Oct 20;8(1):1082. doi: 10.1038/s41467-017-01066-6.


Electronic Structure of the [Cu3(μ-O)3]2+ Cluster in Mordenite Zeolite and Its Effects on the Methane to Methanol Oxidation.

Vogiatzis KD, Li G, Hensen EJM, Gagliardi L, Pidko EA.

J Phys Chem C Nanomater Interfaces. 2017 Oct 12;121(40):22295-22302. doi: 10.1021/acs.jpcc.7b08714. Epub 2017 Sep 8.


Correlation between crystallographic anisotropy and dendritic orientation selection of binary magnesium alloys.

Du J, Guo Z, Zhang A, Yang M, Li M, Xiong S.

Sci Rep. 2017 Oct 19;7(1):13600. doi: 10.1038/s41598-017-12814-5.


Intercalation of Si between MoS2 layers.

van Bremen R, Yao Q, Banerjee S, Cakir D, Oncel N, Zandvliet HJW.

Beilstein J Nanotechnol. 2017 Sep 19;8:1952-1960. doi: 10.3762/bjnano.8.196. eCollection 2017.


Robust Bain distortion in the premartensite phase of a platinum-substituted Ni2MnGa magnetic shape memory alloy.

Singh S, Dutta B, D'Souza SW, Zavareh MG, Devi P, Gibbs AS, Hickel T, Chadov S, Felser C, Pandey D.

Nat Commun. 2017 Oct 18;8(1):1006. doi: 10.1038/s41467-017-00883-z.


Mechanocaloric effects in superionic thin films from atomistic simulations.

Sagotra AK, Errandonea D, Cazorla C.

Nat Commun. 2017 Oct 17;8(1):963. doi: 10.1038/s41467-017-01081-7.


Properties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality.

Patra A, Bates JE, Sun J, Perdew JP.

Proc Natl Acad Sci U S A. 2017 Oct 31;114(44):E9188-E9196. doi: 10.1073/pnas.1713320114. Epub 2017 Oct 17.


Impact of Coulomb Correlations on Magnetic Anisotropy in Mn3Ga Ferrimagnet.

Saha SK, Liu Z, Dutta G.

Sci Rep. 2017 Oct 16;7(1):13221. doi: 10.1038/s41598-017-13276-5.


Anomalous Kondo resonance mediated by semiconducting graphene nanoribbons in a molecular heterostructure.

Li Y, Ngo AT, DiLullo A, Latt KZ, Kersell H, Fisher B, Zapol P, Ulloa SE, Hla SW.

Nat Commun. 2017 Oct 16;8(1):946. doi: 10.1038/s41467-017-00881-1.

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