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Browsing by Author rp00729
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Showing results 1 to 20 of 39
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Title
Author(s)
Issue Date
Ab initio investigation of the structure, stability, and atmospheric distribution of molecular clusters containing H2O, CO2, and N2O
Journal:
Journal of Geophysical Research
Lemke, KH
Seward, TM
2008
Calculations of the water-dimer encapsulations into C84
Journal:
Fullerenes, Nanotubes and Carbon Nanostructures
Slanina, Z
Lu, X
Uhlik, F
Akasaka, T
Lemke, KH
Seward, TM
Nagase, S
Adamowicz, L
2015
Determination of crbon dioxide cluster structures and binding energies from quantum chemistry: magic number and temperature effects in (CO2)n with 2<= n<=16
Proceeding/Conference:
Fall Meeting of the American Geophysical Union, AGU 2014
Lemke, KH
2014
ESI FT-MS and DFT studies of aqueous Au(I) complexes with cysteine and its disulfide form cystine
Journal:
International Journal of Mass Spectrometry
Taczkowska, MA
Tanjaroon, C
Lemke, KH
2016
An Exafs and ab initio study of aquated Cd2+ and chlorocadmium(II) complexes up to 300°C
Proceeding/Conference:
Mineralogical Magazine
Seward, TM
Lemke, KH
Henderson, CMB
Charnock, JM
Sadjadi, S
2011
Experimental and theoretical studies of metal speciation in ore-forming vapors
Proceeding/Conference:
International Ni-Cu-PGE Symposium, NCPS-13
Lemke, KH
2016
Exploring aqueous speciation of lanthanide chloride clusters by electrospray ionization mass spectrometry and quantum chemistry
Proceeding/Conference:
Fall Meeting of the American Geophysical Union, AGU 2013
Lemke, KH
Zhao, Y
2013
Extreme accumulation of nucleotides in simulated hydrothermal pore systems
Journal:
Proceedings of the National Academy of Sciences of the United States of America
Baaske, P
Weinert, FM
Duhr, S
Lemke, KH
Russell, MJ
Braun, D
2007
FT-ICR mass spectrometric and density functional theory studies of solvated cerium chloride clusters
Proceeding/Conference:
Mineralogical Magazine
Lemke, KH
Zhao, Y
2013
FT-ICR mass spectrometry of carbonate clusters: magic clusters and pH effects
Proceeding/Conference:
Mineralogical Magazine
Lemke, KH
Sadjadi, S
Seward, TM
2011
FT-ICR/MS and quantum chemical studies of aqueous polyoxometalates
Proceeding/Conference:
Mineralogical Magazine
Taczkowska, MA
Lemke, KH
Sadjadi, S
Seward, TM
2011
FT-ICR/MS and Quantum Chemical Study of the Aqueous Microsolvation of Cadmium Chloride Complexes
Proceeding/Conference:
Geochimica et Cosmochimica Acta
Lemke, KH
Sadjadi, S
Seward, TM
2010
Gold chloride clusters with Au (iii) and Au (i) probed by FT-ICR mass spectrometry and MP2 theory
Journal:
Physical Chemistry Chemical Physics
Lemke, KH
2014
An hydrothermal experimental study of the cobalt-cobalt oxide redox buffer
Journal:
Chemical Geology
Lemke, KH
Rosenbauer, RJ
Bischoff, JL
Bird, DK
2008
Iron speciation in hydrothermal solutions - an experimental and theoretical study
Proceeding/Conference:
Goldschmidt 2015
Stefansson, A
Seward, TM
Lemke, KH
2015
Iron(III) chloride complexation in hydrothermal solutions: A combined spectrophotometric and density functional theory study
Journal:
Chemical Geology
Stefansson, A
Lemke, KH
Seward, TM
2019
Iron(III) complexation in hydrothermal solutions – An experimental and theoretical study
Proceeding/Conference:
Proceedings of the 15th International Conference on the Properties of Water and Steam
Stefansson, A
Lemke, KH
Seward, TM
2008
Magnesium bicarbonate and carbonate interactions in aqueous solutions: An infrared spectroscopic and quantum chemical study
Journal:
Geochimica et Cosmochimica Acta
Stefánsson, A
Lemke, KH
Bénézeth, P
Schott, J
2017
Mass spectrometric and quantum chemical determination of proton water clustering equilibria
Journal:
Geochimica et Cosmochimica Acta
Likholyot, A
Lemke, KH
Hovey, JK
Seward, TM
2007
Mass spectrometric and quantum chemical studies of gold speciation in water vapor
Proceeding/Conference:
Goldschmidt 2014
Lemke, KH
2014