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1
A Combined Experimental–Theoretical Study on Diels‐Alder Reaction with Bio‐Based Furfural: Towards Renewable Aromatics
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A Combined ExperimentalTheoretical Study on Diels‐Alder Reaction with Bio‐Based Furfural: Towards Renewable Aromatics

Scodeller, I ; De Oliveira Vigier, Karine ; Muller, Eric ; Ma, Changru ; Guégan, Frédéric ; Wischert, Raphael ; Jérôme, François

ChemSusChem, 2021-01, Vol.14 (1), p.313-323 [Periódico revisado por pares]

Germany: Wiley Subscription Services, Inc

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Valence and Conduction Band Densities of States of Metal Halide Perovskites: A Combined Experimental–Theoretical Study
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Valence and Conduction Band Densities of States of Metal Halide Perovskites: A Combined ExperimentalTheoretical Study

Endres, James ; Egger, David A ; Kulbak, Michael ; Kerner, Ross A ; Zhao, Lianfeng ; Silver, Scott H ; Hodes, Gary ; Rand, Barry P ; Cahen, David ; Kronik, Leeor ; Kahn, Antoine

The journal of physical chemistry letters, 2016-07, Vol.7 (14), p.2722-2729 [Periódico revisado por pares]

United States: American Chemical Society

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3
(Isocyano group) lone pair interactions involving coordinated isocyanides: experimental, theoretical and CSD studies
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(Isocyano group) lone pair interactions involving coordinated isocyanides: experimental, theoretical and CSD studies

Mikherdov, Alexander S ; Katkova, Svetlana A ; Novikov, Alexander S ; Efremova, Mariia M ; Reutskaya, Elena Yu ; Kinzhalov, Mikhail A

CrystEngComm, 2020-02, Vol.22 (7), p.1154-1159 [Periódico revisado por pares]

Cambridge: Royal Society of Chemistry

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4
Combined Experimental–Theoretical Characterization of the Hydrido-Cobaloxime [HCo(dmgH)2(PnBu3)]
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Combined ExperimentalTheoretical Characterization of the Hydrido-Cobaloxime [HCo(dmgH)2(PnBu3)]

Bhattacharjee, Anirban ; Chavarot-Kerlidou, Murielle ; Andreiadis, Eugen. S ; Fontecave, Marc ; Field, Martin J ; Artero, Vincent

Inorganic chemistry, 2012-07, Vol.51 (13), p.7087-7093 [Periódico revisado por pares]

United States: American Chemical Society

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5
Hydration of Lanthanoids(III) and Actinoids(III): An Experimental/Theoretical Saga
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Hydration of Lanthanoids(III) and Actinoids(III): An Experimental/Theoretical Saga

D'Angelo, Paola ; Spezia, Riccardo

Chemistry : a European journal, 2012-09, Vol.18 (36), p.11162-11178 [Periódico revisado por pares]

Weinheim: WILEY-VCH Verlag

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6
π-π Noncovalent Interaction Involving 1,2,4- and 1,3,4-Oxadiazole Systems: The Combined Experimental, Theoretical, and Database Study
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π-π Noncovalent Interaction Involving 1,2,4- and 1,3,4-Oxadiazole Systems: The Combined Experimental, Theoretical, and Database Study

Baykov, Sergey V ; Mikherdov, Alexander S ; Novikov, Alexander S ; Geyl, Kirill K ; Tarasenko, Marina V ; Gureev, Maxim A ; Boyarskiy, Vadim P

Molecules (Basel, Switzerland), 2021-09, Vol.26 (18), p.5672 [Periódico revisado por pares]

Switzerland: MDPI AG

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7
Highly fluorescent Zn-doped carbon dots as Fenton reaction-based bio-sensors: an integrative experimental-theoretical consideration
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Highly fluorescent Zn-doped carbon dots as Fenton reaction-based bio-sensors: an integrative experimental-theoretical consideration

Xu, Quan ; Liu, Yao ; Su, Rigu ; Cai, Lulu ; Li, Bofan ; Zhang, Yingyuan ; Zhang, Linzhou ; Wang, Yajun ; Wang, Yan ; Li, Neng ; Gong, Xiao ; Gu, Zhipeng ; Chen, Yusheng ; Tan, Yanglan ; Dong, Chenbo ; Sreeprasad, Theruvakkattil Sreenivasan

Nanoscale, 2016-11, Vol.8 (41), p.17919-17927 [Periódico revisado por pares]

England

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8
Mechanisms of syn-Insertion of Alkynes and Allenes into Gold–Silicon Bonds: A Comprehensive Experimental/Theoretical Study
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Mechanisms of syn-Insertion of Alkynes and Allenes into Gold–Silicon Bonds: A Comprehensive Experimental/Theoretical Study

Joost, Maximilian ; Estevez, Laura ; Mallet-Ladeira, Sonia ; Miqueu, Karinne ; Amgoune, Abderrahmane ; Bourissou, Didier

Journal of the American Chemical Society, 2014-07, Vol.136 (29), p.10373-10382 [Periódico revisado por pares]

United States: American Chemical Society

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9
Mechanistic Basis of Conductivity in Carbon Dioxide-Expanded Electrolytes: A Joint Experimental–Theoretical Study
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Mechanistic Basis of Conductivity in Carbon Dioxide-Expanded Electrolytes: A Joint ExperimentalTheoretical Study

Nilles, Christian K. ; Borkowski, Ashley K. ; Bartlett, Elizabeth R. ; Stalcup, Matthew A. ; Lee, Hyun-Jin ; Leonard, Kevin C. ; Subramaniam, Bala ; Thompson, Ward H. ; Blakemore, James D.

Journal of the American Chemical Society, 2024-01, Vol.146 (4), p.2398-2410 [Periódico revisado por pares]

United States: American Chemical Society

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10
Investigating Light-Driven Hole Injection and Hydrogen Evolution Catalysis at Dye-Sensitized NiO Photocathodes: A Combined Experimental–Theoretical Study
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Investigating Light-Driven Hole Injection and Hydrogen Evolution Catalysis at Dye-Sensitized NiO Photocathodes: A Combined ExperimentalTheoretical Study

Massin, Julien ; Bräutigam, Maximilian ; Bold, Sebastian ; Wächtler, Maria ; Pavone, Michele ; Muñoz-García, Ana B ; Dietzek, Benjamin ; Artero, Vincent ; Chavarot-Kerlidou, Murielle

Journal of physical chemistry. C, 2019-07, Vol.123 (28), p.17176-17184 [Periódico revisado por pares]

American Chemical Society

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