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在“
ACS电子期刊
”中,
命中:
31
条,耗时:小于0.01 秒
在所有数据库中总计命中:
493
条
1.
Role of Core Electrons in Quantum Dynamics Using TDDFT
作者:
Nicolás O. Foglia
;
Uriel N. Morzan
;
Dario A. Estrin
;
Damian A. Scherlis
;
Mariano C. Gonzalez Lebrero
刊名:Journal of Chemical Theory and Computation
出版年:2017
2.
Role of Hydroxyl Groups in the Preferential Oxidation of CO over Copper Oxide–Cerium Oxide Catalysts
作者:
Arantxa Davó-Quiñ
onero
;
Miriam Navlani-García
;
Dolores Lozano-Castelló
;
Agustín Bueno-López
;
James A. Anderson
刊名:ACS Catalysis
出版年:2016
3.
3D MoS2 Composition Aerogels as Chemosensors and Adsorbents for Colorimetric Detection and High-Capacity Adsorption of Hg2+
作者:
Lihua Zhi
;
Wei Zuo
;
Fengjuan Chen
;
Baodui Wang
刊名:ACS Sustainable Chemistry & Engineering
出版年:2016
4.
Combined Theoretical and in Situ Scattering Strategies for Optimized Discovery and Recovery of High-Pressure Phases: A Case Study of the GaN–Nb2O5 System
作者:
William R. Woerner
;
Guang-Rui Qian
;
Artem R. Oganov
;
Peter W. Stephens
;
H. A. Naveen Dharmagunawardhane
;
Alexandra Sinclair
;
John B. Parise
刊名:Inorganic Chemistry
出版年:2016
5.
Modeling Vapor鈥揕iquid鈥揕iquid Phase Equilibria in Fischer鈥揟ropsch Syncrude
作者:
Braden D. Kelly
;
Arno de Klerk
刊名:Industrial & Engineering Chemistry Research
出版年:2015
6.
Thermodynamic Characterization of Halide鈭捪€ Interactions in Solution Using 鈥淭wo-Wall鈥?Aryl Extended Calix[4]pyrroles as Model System
作者:
Louis Adriaenssens
;
Guzm谩n Gil-Ram铆rez
;
Antonio Frontera
;
David Qui帽
onero
;
Eduardo C. Escudero-Ad谩n
;
Pablo Ballester
刊名:Journal of the American Chemical Society
出版年:2014
7.
Is the Use of Diffuse Functions Essential for the Properly Description of Noncovalent Interactions Involving Anions?
作者:
Antonio Bauz谩
;
David Qui帽
onero
;
Pere M. Dey脿
;
Antonio Frontera
刊名:The Journal of Physical Chemistry A
出版年:2013
8.
An Equation of State-Based Modeling Approach for Estimating the Partial Molar Volume of Penetrants and Polymers in Binary Mixtures
作者:
Muhammad Ahsan Bashir
;
Vincent Monteil
;
Vasileios Kanellopoulos
;
Mohammad Al-haj Ali
;
Timothy F. L. McKenna
刊名:Industrial & Engineering Chemistry Research
出版年:2013
9.
Feasibility of Single-Walled Carbon Nanotubes as Materials for CO2 Adsorption: A DFT Study
作者:
David Qui帽
onero
;
Antonio Frontera
;
Pere M. Dey脿
刊名:The Journal of Physical Chemistry C
出版年:2012
10.
Conformational Analysis of a Model Synthetic Prodiginine
作者:
Mar铆a Garc铆a-Valverde
;
Ignacio Alfonso
;
David Qui帽
onero
;
Roberto Quesada
刊名:The Journal of Organic Chemistry
出版年:2012
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