-
1
-
-
84905897969
-
New recipe produces ammonia from air, water, and sunlight
-
R. F. Service New recipe produces ammonia from air, water, and sunlight Science 2014 345 610
-
(2014)
Science
, vol.345
, pp. 610
-
-
Service, R.F.1
-
3
-
-
80054004803
-
Solid-state electrochemical synthesis of ammonia: A review
-
A. M. Amar R. Lan C. T. G. Petit Solid-state electrochemical synthesis of ammonia: a review J. Solid State Electrochem. 2011 15 1845 1860
-
(2011)
J. Solid State Electrochem.
, vol.15
, pp. 1845-1860
-
-
Amar, A.M.1
Lan, R.2
Petit, C.T.G.3
-
4
-
-
84905907953
-
Ammonia synthesis by N2 and steam electrolysis in molten hydroxide suspensions of nanoscale Fe2O3
-
S. Licht B. Cui B. Wang F. F. Li J. Lau S. G. Liu Ammonia synthesis by N2 and steam electrolysis in molten hydroxide suspensions of nanoscale Fe2O3 Science 2014 345 637
-
(2014)
Science
, vol.345
, pp. 637
-
-
Licht, S.1
Cui, B.2
Wang, B.3
Li, F.F.4
Lau, J.5
Liu, S.G.6
-
5
-
-
79954529303
-
Solar Water Splitting: Progress Using Hematite (α-Fe2O3) Photoelectrodes
-
K. Sivula F. Le Formal M. Grätzel Solar Water Splitting: Progress Using Hematite (α-Fe2O3) Photoelectrodes ChemSusChem 2011 4 432 449
-
(2011)
ChemSusChem
, vol.4
, pp. 432-449
-
-
Sivula, K.1
Le Formal, F.2
Grätzel, M.3
-
6
-
-
84873124833
-
In rust we trust. Hematite- The prospective inorganic backbone for artificial photosynthesis
-
D. K. Bora A. Braun E. C. Constable In rust we trust. Hematite-the prospective inorganic backbone for artificial photosynthesis Energy Environ. Sci. 2013 6 407 425
-
(2013)
Energy Environ. Sci.
, vol.6
, pp. 407-425
-
-
Bora, D.K.1
Braun, A.2
Constable, E.C.3
-
7
-
-
84865127852
-
Water Oxidation on Pure and Doped Hematite (0001) Surfaces: Prediction of Co and Ni as Effective Dopants for Electrocatalysis
-
P. Liao J. A. Keith E. A. Carter Water Oxidation on Pure and Doped Hematite (0001) Surfaces: Prediction of Co and Ni as Effective Dopants for Electrocatalysis J. Am. Chem. Soc. 2012 134 13296 13309
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 13296-13309
-
-
Liao, P.1
Keith, J.A.2
Carter, E.A.3
-
8
-
-
84872721573
-
A new hematite photoanode doping strategy for solar water splitting: Oxygen vacancy generation
-
T.-Y. Yang H.-Y. Kang U. Sim Y.-J. Lee J.-H. Lee B. Koo K. T. Nam Y.-C. Joo A new hematite photoanode doping strategy for solar water splitting: oxygen vacancy generation Phys. Chem. Chem. Phys. 2013 15 2117 2124
-
(2013)
Phys. Chem. Chem. Phys.
, vol.15
, pp. 2117-2124
-
-
Yang, T.-Y.1
Kang, H.-Y.2
Sim, U.3
Lee, Y.-J.4
Lee, J.-H.5
Koo, B.6
Nam, K.T.7
Joo, Y.-C.8
-
9
-
-
84878353533
-
Water adsorption and dissociation on α-Fe2O3(0001): PBE + U calculations
-
M.-T. Nguyen N. Seriani R. Gebauer Water adsorption and dissociation on α-Fe2O3(0001): PBE + U calculations J. Chem. Phys. 2013 138 194709
-
(2013)
J. Chem. Phys.
, vol.138
, pp. 194709
-
-
Nguyen, M.-T.1
Seriani, N.2
Gebauer, R.3
-
10
-
-
84907207926
-
Photo-driven oxidation of water on α-Fe2O3 surfaces: An ab initio study
-
M.-T. Nguyen N. Seriani S. Piccinin R. Gebauer Photo-driven oxidation of water on α-Fe2O3 surfaces: An ab initio study J. Chem. Phys. 2013 40 064703
-
(2013)
J. Chem. Phys.
, vol.40
, pp. 064703
-
-
Nguyen, M.-T.1
Seriani, N.2
Piccinin, S.3
Gebauer, R.4
-
12
-
-
84899584700
-
Graphene Supported on Hematite Surfaces: A Density Functional Study
-
M.-T. Nguyen R. Gebauer Graphene Supported on Hematite Surfaces: A Density Functional Study J. Phys. Chem. C 2014 118 8455
-
(2014)
J. Phys. Chem. C
, vol.118
, pp. 8455
-
-
Nguyen, M.-T.1
Gebauer, R.2
-
13
-
-
33845405133
-
New Benchmark for Water Photooxidation by Nanostructured α-Fe2O3 Films
-
A. Kay I. Cesar M. Grätzel New Benchmark for Water Photooxidation by Nanostructured α-Fe2O3 Films J. Am. Chem. Soc. 2006 128 15714
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 15714
-
-
Kay, A.1
Cesar, I.2
Grätzel, M.3
-
15
-
-
78649537028
-
Catalytic FriedelCrafts Acylation and Benzoylation of Aromatic Compounds Using Activated Hematite as a Novel Heterogeneous Catalyst
-
H. Sharghi M. Jokar M. M. Doroodmand R. Khalifeh Catalytic FriedelCrafts Acylation and Benzoylation of Aromatic Compounds Using Activated Hematite as a Novel Heterogeneous Catalyst Adv. Synth. Catal. 2010 17 3031
-
(2010)
Adv. Synth. Catal.
, vol.17
, pp. 3031
-
-
Sharghi, H.1
Jokar, M.2
Doroodmand, M.M.3
Khalifeh, R.4
-
18
-
-
78649950687
-
Two-dimensional polymer formation on surfaces: Insight into the roles of precursor mobility and reactivity
-
M. Bieri M.-T. Nguyen O. Gröning J. Cai M. Treier K. Aït-Mansour P. Ruffieux C. A. Pignedoli D. Passerone M. Kastler K. Müllen R. Fasel Two-dimensional polymer formation on surfaces: insight into the roles of precursor mobility and reactivity J. Am. Chem. Soc. 2010 132 16669
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 16669
-
-
Bieri, M.1
Nguyen, M.-T.2
Gröning, O.3
Cai, J.4
Treier, M.5
Aït-Mansour, K.6
Ruffieux, P.7
Pignedoli, C.A.8
Passerone, D.9
Kastler, M.10
Müllen, K.11
Fasel, R.12
-
21
-
-
70349568754
-
QUANTUM ESPRESSO: A modular and open-source software project for quantum simulations of materials
-
P. Giannozzi S. Baroni N. Bonini M. Calandra R. Car C. Cavazzoni D. Ceresoli G. L. Chiarotti M. Cococcioni I. Dabo et al., QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials J. Phys.: Condens. Matter 2009 21 395502
-
(2009)
J. Phys.: Condens. Matter
, vol.21
, pp. 395502
-
-
Giannozzi, P.1
Baroni, S.2
Bonini, N.3
Calandra, M.4
Car, R.5
Cavazzoni, C.6
Ceresoli, D.7
Chiarotti, G.L.8
Cococcioni, M.9
Dabo, I.10
-
22
-
-
20544463457
-
Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
-
D. Vanderbilt Soft self-consistent pseudopotentials in a generalized eigenvalue formalism Phys. Rev. B: Condens. Matter Mater. Phys. 1990 41 7892
-
(1990)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.41
, pp. 7892
-
-
Vanderbilt, D.1
-
23
-
-
36048949244
-
Ultrasoft pseudopotentials in time-dependent density-functional theory
-
B. Walker R. Gebauer Ultrasoft pseudopotentials in time-dependent density-functional theory J. Chem. Phys. 2007 127 164106
-
(2007)
J. Chem. Phys.
, vol.127
, pp. 164106
-
-
Walker, B.1
Gebauer, R.2
-
24
-
-
84255160976
-
A theoretical evaluation of possible transition metal electro-catalysts for N2 reduction
-
E. Skúlason T. Bligaard S. Gudmundsdóttir F. Studt J. Rossmeisl F. Abild-Pedersen T. Vegge H. Jónsson J. K. Nørskov A theoretical evaluation of possible transition metal electro-catalysts for N2 reduction Phys. Chem. Chem. Phys. 2012 14 1235 1245
-
(2012)
Phys. Chem. Chem. Phys.
, vol.14
, pp. 1235-1245
-
-
Skúlason, E.1
Bligaard, T.2
Gudmundsdóttir, S.3
Studt, F.4
Rossmeisl, J.5
Abild-Pedersen, F.6
Vegge, T.7
Jónsson, H.8
Nørskov, J.K.9
-
25
-
-
84877248788
-
DFT based study of transition metal nano-clusters for electrochemical NH3 production
-
J. G. Howalt T. Bligaard J. Rossmeisl T. Vegge DFT based study of transition metal nano-clusters for electrochemical NH3 production Phys. Chem. Chem. Phys. 2013 15 7785
-
(2013)
Phys. Chem. Chem. Phys.
, vol.15
, pp. 7785
-
-
Howalt, J.G.1
Bligaard, T.2
Rossmeisl, J.3
Vegge, T.4
|