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Lancet, The, ISSN 0140-6736, 2009, Volume 373, Issue 9679, pp. 1974 - 1986
Journal Article
Neurosurgery, ISSN 0148-396X, 06/2015, Volume 76, Issue 6, pp. N8 - N8
Journal Article
Neurosurgery, ISSN 0148-396X, 05/2015, Volume 76, Issue 5, pp. N10 - N10
Journal Article
Neurosurgery, ISSN 0148-396X, 04/2015, Volume 76, Issue 4, pp. N9 - N9
Journal Article
Neurosurgery, ISSN 0148-396X, 03/2015, Volume 76, Issue 3, pp. N8 - N8
Journal Article
Neurosurgery, ISSN 0148-396X, 11/2014, Volume 75, Issue 5, pp. N9 - N9
Journal Article
Neurosurgery, ISSN 0148-396X, 07/2014, Volume 75, Issue 1, pp. N7 - N7
Journal Article
Journal of Catalysis, ISSN 0021-9517, 04/2014, Volume 312, pp. 108 - 122
[Display omitted] •CO2 electroreduction mechanisms are determined with density functional theory (DFT).•DFT calculations incorporate the role of kinetic... 
CO2 electroreduction | Cu electrodes | Solvation | Kinetic barrier | Reaction mechanism | Density functional theory | Electrochemical | electroreduction | METHANOL SYNTHESIS | ELECTRIC-FIELD | AB-INITIO | CHEMISTRY, PHYSICAL | ENGINEERING, CHEMICAL | Cu | OXYGEN REDUCTION | COPPER SINGLE-CRYSTAL | CARBON-DIOXIDE REDUCTION | ACTIVATION-ENERGIES | THEORETICAL-ANALYSIS | C-H | WATER
Journal Article
Neurosurgery, ISSN 0148-396X, 02/2014, Volume 74, Issue 2, pp. N9 - N9
Journal Article
Science, ISSN 0036-8075, 04/2017, Volume 356, Issue 6335, pp. 299 - 303
Journal Article
Neurosurgery, ISSN 0148-396X, 01/2014, Volume 74, Issue 1, pp. N9 - N9
Journal Article
Catalysis Today, ISSN 0920-5861, 02/2019, Volume 323, Issue C, pp. 35 - 43
Journal Article
Neurosurgery, ISSN 0148-396X, 12/2013, Volume 73, Issue 6, pp. N8 - N8
Journal Article
Angewandte Chemie International Edition, ISSN 1433-7851, 02/2013, Volume 52, Issue 9, pp. 2459 - 2462
On the right path: Based on DFT calculations (incorporating the role of water solvation) of the activation barriers of elementary steps, a new path that leads... 
carbon dioxide | density functional calculations | renewable energy | heterogeneous catalysis | kinetics | METHANOL | ETHYLENE | HYDROCARBONS | GAS | ELECTROCHEMICAL REDUCTION | CARBON-DIOXIDE | CHEMISTRY, MULTIDISCIPLINARY | Heterogeneous catalysis | Greenhouse effect | Copper | Atmospheric carbon dioxide
Journal Article
Chemical Society reviews, ISSN 0306-0012, 11/2014, Volume 43, Issue 22, pp. 7536 - 7547
Advances in the fundamental understanding of alkane activation on oxide surfaces are essential for developing new catalysts that efficiently and selectively... 
Journal Article
Chemical Society Reviews, ISSN 0306-0012, 10/2014, Volume 43, Issue 22, pp. 7536 - 7547
Advances in the fundamental understanding of alkane activation on oxide surfaces are essential for developing new catalysts that efficiently and selectively... 
H BOND-CLEAVAGE | METHANE | DESORPTION-KINETICS | CHEMISTRY | PROPANE SIGMA-COMPLEXES | PDO | ENTROPIES | ADSORPTION | CHEMISTRY, MULTIDISCIPLINARY | DISSOCIATIVE CHEMISORPTION | N-BUTANE
Journal Article
2014, RSC catalysis series, ISBN 1849734518, Volume no. 14, x, 266
The field of computational catalysis has existed in one form or another for at least 30 years. Its ultimate goal - the design of a novel catalyst entirely from... 
Computer simulation | Catalysis | Chemistry | Science | Industrial & Technical | Physical & Theoretical | Mathematical models
Book
Journal of Physical Chemistry C, ISSN 1932-7447, 07/2016, Volume 120, Issue 28, pp. 15173 - 15184
CO poisoning as a probe for oxygen reduction reaction (ORR) active sites was examined on both iron nitrogen coordinated catalysts supported on carbon (FeNC)... 
ACTIVE-SITES | MATERIALS SCIENCE, MULTIDISCIPLINARY | X-RAY-ABSORPTION | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | OXYGEN REDUCTION REACTION | TOTAL-ENERGY CALCULATIONS | CATHODE CATALYSTS | NITROGEN-DOPED GRAPHENE | CARBON CATALYSTS | FE/N/C-CATALYSTS | DENSITY-FUNCTIONAL-THEORY | PEM FUEL-CELLS
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