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Selective oxidation of methane by the bis(μ-oxo)dicopper core stabilized on ZSM-5 and mordenite zeolites
MH Groothaert et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Theoretical methods that help understanding the structure and reactivity of gas phase ions
JM Mercero et al.
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2005)
Gas-phase catalysis by atomic and cluster metal ions: The ultimate single-site catalysts
DK Bohme et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2005)
Gas-phase reactions of lanthanide cations with alcohols
JA Carretas et al.
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2004)
Matrix isolation infrared spectroscopic and theoretical study of the reactions of beryllium atoms with methanol
ZG Huang et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Competitive paths for methanol decomposition on Pt(111)
J Greeley et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Reactions of vanadium and niobium oxides with methanol
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JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Ion chemistry of OV(OCH3)3 in the gas phase:: Molecular cations and anions and their primary fragmentations
D Schröder et al.
INORGANIC CHEMISTRY (2004)
C-N coupling of methane and ammonia by bimetallic platinum-gold cluster cations
K Koszinowski et al.
ORGANOMETALLICS (2004)
The oxidative dehydrogenation of propane using gallium-molybdenum oxide-based catalysts
T Davies et al.
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2004)
Perspectives on some challenges and approaches for developing the next generation of selective, low temperature, oxidation catalysts for alkane hydroxylation based on the CH activation reaction
RA Periana et al.
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2004)
On the spin-forbiddeness of gas-phase ion-molecule reactions: a fruitful intersection of experimental and computational studies
H Schwarz
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2004)
Gas phase ion chemistry of transition metal clusters: Production, reactivity, and catalysis
RAJ O'Hair et al.
JOURNAL OF CLUSTER SCIENCE (2004)
C-H- and N-H-activation by gaseous Rh2+ and PtRh+ cluster ions
K Koszinowski et al.
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2004)
Matrix isolation infrared spectroscopic and density functional theoretical studies of the reactions of scandium atoms with methanol
MH Chen et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Activation of C-H/H-H bonds by rhodium(II) porphyrin bimetalloradicals
WH Cui et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Is spin conserved in heavy metal systems?: Experimental and theoretical studies of the reaction of Re+ with methane
MM Armentrout et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Gas phase contributions to the catalytic formation of HCN from CH4 and NH3 over Pt: An in situ study by molecular beam mass spectrometry with threshold ionization
R Horn et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2004)
Selective oxidation of methane to methanol catalyzed, with C-H activation, by homogeneous, cationic gold
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ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2004)
Matrix isolation FTIR spectroscopic and density functional theoretical studies of the reactions of magnesium atoms with methanol
ZG Huang et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Additivity effects in the reactivities of bimetallic cluster ions PtmAun+
K Koszinowski et al.
CHEMPHYSCHEM (2003)
Deposition dynamics and chemical properties of size-selected Ir clusters on TiO2
M Aizawa et al.
SURFACE SCIENCE (2003)
Alkane oxidation by VO2+ in the gas phase:: A unique dependence of reactivity on the chain length
M Engeser et al.
ORGANOMETALLICS (2003)
Guided ion beam studies of transition metal-ligand thermochemistry
PB Armentrout
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2003)
Probing cooperative effects in bimetallic clusters:: Indications of C-N coupling of CH4 and NH3 mediated by the cluster ion PtAu+ in the gas phase
K Koszinowski et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
A spin-orbit coupling study on the spin inversion processes in the direct methane-to-methanol conversion by FeO+
Y Shiota et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Challenging metal-based transformations. From single-bond activation to catalysis and metal laquinonoids
D Milstein
PURE AND APPLIED CHEMISTRY (2003)
Catalytic gas phase oxidation of methanol to formaldehyde
T Waters et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
The impact of nanoscience on heterogeneous catalysis
AT Bell
SCIENCE (2003)
Chemistry, spectroscopy and the role of supported vanadium oxides in heterogeneous catalysis
BM Weckhuysen et al.
CATALYSIS TODAY (2003)
Control of reactivity in C-H bond breaking reactions on oxide catalysts: Methanol oxidation on supported molybdenum oxide
ST Oyama et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Relativistic effects in gas-phase ion chemistry: An experimentalist's view
H Schwarz
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2003)
Carbon-fluorine bond activation - looking at and learning from unsolvated systems
U Mazurek et al.
CHEMICAL COMMUNICATIONS (2003)
Homogeneous and heterogeneous catalysis: Bridging the gap through surface organometallic chemistry
C Coperet et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2003)
Electrospray ionization tandem mass spectrometry in high-throughput screening of homogeneous catalysts
P Chen
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2003)
Spin forbidden chemical reactions of transition metal compounds. New ideas and new computational challenges
R Poli et al.
CHEMICAL SOCIETY REVIEWS (2003)
Catalysis - From philosopher's stone to Wilhelm Ostwald
G Ertl et al.
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS (2003)
Two-state reactivity mechanisms of hydroxylation and epoxidation by cytochrome P-450 revealed by theory
S Shaik et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2002)
Oxidation of methanol to formaldehyde catalyzed by V2O5.: A density functional theory study
P Boulet et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
A density functional theory study of the oxidation of methanol to formaldehyde over vanadia supported on silica, titania, and zirconia
RZ Khaliullin et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
Studies of metal oxide clusters: Elucidating reactive sites responsible for the activity of transition metal oxide catalysts
KA Zemski et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
A first-principles study of methanol decomposition on Pt(111)
J Greeley et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)
Gas-phase activation of silane, disilane and germane by actinide ions; and collision induced dissociation of metal oxide ions in TOF-MS
JK Gibson
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2002)
Selective alkane transformations via radicals and radical cations: Insights into the activation step from experiment and theory
AA Fokin et al.
CHEMICAL REVIEWS (2002)
A periodic density functional theory study of the dehydrogenation of methanol over Pt(111)
SK Desai et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
Partial oxidation of methanol to formaldehyde on a model supported monolayer vanadia catalyst: vanadia on TiO2(110)
QG Wang et al.
SURFACE SCIENCE (2002)
Carbon 13 and D kinetic isotope effects in the reactions of CH4 with O(1D) and OH:: New laboratory measurements and their implications for the isotopic composition of stratospheric methane
G Saueressig et al.
JOURNAL OF GEOPHYSICAL RESEARCH-ATMOSPHERES (2001)
A theoretical study of alcohol oxidation by ferrate
T Ohta et al.
JOURNAL OF ORGANIC CHEMISTRY (2001)
Platinum dioxide cation:: Easy to generate experimentally but difficult to describe theoretically
M Brönstrup et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
Catalytic conversion of methane to more useful chemicals and fuels: a challenge for the 21st century
JH Lunsford
CATALYSIS TODAY (2000)
Methane-to-methanol conversion by first-row transition-metal oxide ions:: ScO+TiO+, VO+, CrO+, MnO+, FeO+, CoO+, NiO+, and CuO+
Y Shiota et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Concepts of metal-mediated methane functionalization.: An intersection of experiment and theory
H Schwarz et al.
PURE AND APPLIED CHEMISTRY (2000)
Gas phase reactivity of small cationic cobalt clusters towards methanol
ÅML Oiestad et al.
CHEMICAL PHYSICS (2000)
Reaction pathways for the oxidation of methanol to formaldehyde by an iron-oxo species
K Yoshizawa et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2000)
Acetylene cyclotrimerization on supported size-selected Pdn clusters (1≤n≤30):: one atom is enough!
S Abbet et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Some reactions and thermochemistry of NbO3-:: oxidation and reduction, hydrogen bond strength, and catalytic activation of primary alcohols
P Jackson et al.
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2000)
Matrix isolation infrared and density functional theoretical studies of cryogenic reactions of silicon atoms with dimethyl ether and methanol: new route to generation and stabilization of transient silanones
VN Khabashesku et al.
JOURNAL OF ORGANOMETALLIC CHEMISTRY (2000)
Direct methane-methanol and benzene-phenol conversions on Fe-ZSM-5 zeolite: Theoretical predictions on the reaction pathways and energetics
K Yoshizawa et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)
Methane activation by platinum cluster ions in the gas phase:: effects of cluster charge on the Pt4 tetramer
U Achatz et al.
CHEMICAL PHYSICS LETTERS (2000)
Theoretical studies of some transition-metal-mediated reactions of industrial and synthetic importance
M Torrent et al.
CHEMICAL REVIEWS (2000)
Theoretical studies on reactions of transition-metal complexes
SQ Niu et al.
CHEMICAL REVIEWS (2000)
The enhancement effects of added methanol on methane-selective oxidation in the gas phase reaction of CH4-O-2-NO2
YH Teng et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2000)
Ground and excited states of PtCH2+: assessment of the no-pair Douglas-Kroll ab initio model potential method
F Rakowitz et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2000)
Formation of an iron-oxo species upon decomposition of dinitrogen oxide on a model of Fe-ZSM-5 zeolite
K Yoshizawa et al.
BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN (2000)
Two-state reactivity as a new concept in organometallic chemistry
D Schroder et al.
ACCOUNTS OF CHEMICAL RESEARCH (2000)