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38,194
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1.
Stationary Conditions of the Electron Density Along the Reaction Path: Connection with Conceptual DFT and
Information
Theory
作者:
Carlos A. GonzalezEmilio Squitieri
;
Hector J. Franco
;
Luis C. Rincon
刊名:Journal of Physical Chemistry A
出版年:2017
2.
Bond Order Conservation Strategies in Catalysis Applied to the NH3 Decomposition Reaction
作者:
Liang YuFrank Abild-Pedersen
刊名:ACS Catalysis
出版年:2017
3.
Programmed Transfer of Sequence
Information
into a Molecularly Imprinted Polymer for Hexakis(2,2′-bithien-5-yl) DNA Analogue Formation toward Single-Nucleotide-Polymorphism Detection
作者:
Katarzyna BartoldAgnieszka Pietrzyk-Le
;
Tan-Phat HuynhZofia Iskierko
;
Marta Sosnowska
;
Krzysztof Noworyta
;
Wojciech Lisowski
;
Francesco Sannicolò
;
Silvia Cauteruccio
;
Emanuela Licandro
;
Francis D’Souza
;
Wlodzimierz Kutner
刊名:ACS Applied Materials & Interfaces
出版年:2017
4.
Probing Structural Perturbation in a Bent Molecular Crystal with Synchrotron Infrared Microspectroscopy and Periodic Density Functional
Theory
Calculations
作者:
Ljupčo Pejov
;
Manas K. PandaTaro Moriwaki
;
Panče Naumov
刊名:Journal of the American Chemical Society
出版年:2017
5.
Observation of the Strong Electronic Coupling in Near-Infrared-Absorbing Tetraferrocene aza-Dipyrromethene and aza-BODIPY with Direct Ferrocene−α- and Ferrocene−β-Pyrrole Bonds: Toward Molecular Machinery with Four-Bit
Information
Storage Capacity
作者:
Yuriy V. Zatsikha
;
Cole D. Holstrom
;
Kullapa Chanawanno
;
Allen J. Osinski
;
Christopher J. ZieglerVictor N. Nemykin
刊名:Inorganic Chemistry
出版年:2017
6.
NMR Spectra through the Eyes of a Student: Eye Tracking Applied to NMR Items
作者:
Joseph J. Topczewski
;
Anna M. Topczewski
;
Hui Tang
;
Lisa K. Kendhammer
;
Norbert J. Pienta
刊名:Journal of Chemical Education
出版年:2017
7.
Evidence of Ion-Pairing in Cationic Brushes from Evaluation of Brush Charging and Structure by Electrokinetic and Surface Conductivity Analysis
作者:
Ralf ZimmermannGesine Gunkel-Grabole
;
Johanna Bünsow
;
Carsten Werner
;
Wilhelm T. S. Huck
;
Jérôme F. L. Duval
刊名:Journal of Physical Chemistry C
出版年:2017
8.
Identification of Second Shell Coordination in Transition Metal Species Using Theoretical XANES: Example of Ti–O–(C, Si, Ge) Complexes
作者:
Charles S. Spanjers
;
Pascal Guillo
;
T. Don Tilley
;
Michael J. Janik
;
Robert M. Rioux
刊名:Journal of Physical Chemistry A
出版年:2017
9.
Influence of Radical Bridges on Electron Spin Coupling
作者:
Torben Steenbock
;
David A. Shultz
;
Martin L. Kirk
;
Carmen Herrmann
刊名:Journal of Physical Chemistry A
出版年:2017
10.
Methods and Protocols for Electrochemical Energy Storage Materials Research
作者:
Elahe Talaie
;
Patrick Bonnick
;
Xiaoqi Sun
;
Quan Pang
;
Xiao Liang
;
Linda F. Nazar
刊名:Chemistry of Materials
出版年:2017
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