Sandro Jahn

Sandro Jahn

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Sandro Jahn

Sandro Jahn

Publications by authors named "Sandro Jahn"

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16Publications

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From Molten Calcium Aluminates through Phase Transitions to Cement Phases.

Adv Sci (Weinh) 2020 Jan 26;7(2):1902209. Epub 2019 Nov 26.

State Key Laboratory of Silicate Materials for Architectures Wuhan University of Technology Wuhan 430070 China.

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http://dx.doi.org/10.1002/advs.201902209DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC6974954PMC
January 2020

Aqueous sodium hydroxide (NaOH) solutions at high pressure and temperature: insights from in situ Raman spectroscopy and ab initio molecular dynamics simulations.

Phys Chem Chem Phys 2018 Aug;20(33):21629-21639

Institute of Geology and Mineralogy, University of Cologne, Zülpicher Straße 49b, 50674 Köln, Germany.

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http://xlink.rsc.org/?DOI=C8CP00376A
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http://dx.doi.org/10.1039/c8cp00376aDOI Listing
August 2018

Cation Hydration in Supercritical NaOH and HCl Aqueous Solutions.

J Phys Chem B 2017 12 8;121(50):11383-11389. Epub 2017 Dec 8.

Fakultät Physik/DELTA, Technische Universität Dortmund , 44221 Dortmund, Germany.

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http://dx.doi.org/10.1021/acs.jpcb.7b09688DOI Listing
December 2017

Beyond sixfold coordinated Si in SiO glass at ultrahigh pressures.

Proc Natl Acad Sci U S A 2017 09 5;114(38):10041-10046. Epub 2017 Sep 5.

Center for Advanced Radiation Sources, University of Chicago, Chicago, IL 60637.

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http://dx.doi.org/10.1073/pnas.1708882114DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5617297PMC
September 2017

Development of chemical and topological structure in aluminosilicate liquids and glasses at high pressure.

J Phys Condens Matter 2015 Mar 9;27(10):105103. Epub 2015 Feb 9.

School of Earth Sciences, University of Bristol, Wills Memorial Building, Queens Road, Bristol, BS8 1RJ, UK. Centre for Science at Extreme Conditions, School of Physics and Astronomy, University of Edinburgh, Edinburgh, EH9 3JZ, UK.

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http://stacks.iop.org/0953-8984/27/i=10/a=105103?key=crossre
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http://dx.doi.org/10.1088/0953-8984/27/10/105103DOI Listing
March 2015

Microscopic structure of water at elevated pressures and temperatures.

Proc Natl Acad Sci U S A 2013 Apr 11;110(16):6301-6. Epub 2013 Mar 11.

Fakultät Physik/Dortmund Electron Accelerator, Technische Universität Dortmund, Dortmund, Germany.

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http://dx.doi.org/10.1073/pnas.1220301110DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3631681PMC
April 2013

Structural transformations on vitrification in the fragile glass-forming system CaAl2O4.

Phys Rev Lett 2012 Dec 5;109(23):235501. Epub 2012 Dec 5.

Centre for Science at Extreme Conditions, School of Physics and Astronomy, University of Edinburgh, Edinburgh EH9 3JZ, United Kingdom.

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https://link.aps.org/doi/10.1103/PhysRevLett.109.235501
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http://dx.doi.org/10.1103/PhysRevLett.109.235501DOI Listing
December 2012

Vibrational mode frequencies of H4SiO4, D4SiO4, H6Si2O7, and H6Si3O9 in aqueous environment, obtained from ab initio molecular dynamics.

J Chem Phys 2012 Oct;137(16):164506

GFZ German Research Centre for Geosciences, Section 3.3, Telegrafenberg, 14473 Potsdam, Germany.

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http://dx.doi.org/10.1063/1.4761824DOI Listing
October 2012

Vibrational mode frequencies of silica species in SiO2-H2O liquids and glasses from ab initio molecular dynamics.

J Chem Phys 2012 Apr;136(15):154501

GFZ German Research Centre for Geosciences, Section 3.3, Telegrafenberg, 14473 Potsdam, Germany.

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http://dx.doi.org/10.1063/1.3703667DOI Listing
April 2012

The structure of liquid calcium aluminates as investigated using neutron and high energy x-ray diffraction in combination with molecular dynamics simulation methods.

J Phys Condens Matter 2011 Apr 24;23(15):155101. Epub 2011 Mar 24.

Conditions Extrêmes et Matériaux: Haute Température et Irradiation (CEMHTI), Université d'Orléans, 1d Avenue de la Recherche Scientifique, 45071 Orléans Cedex 2, France.

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http://dx.doi.org/10.1088/0953-8984/23/15/155101DOI Listing
April 2011

Speciation in aqueous MgSO(4) fluids at high pressures and high temperatures from ab initio molecular dynamics and Raman spectroscopy.

J Phys Chem B 2010 Dec 4;114(47):15565-72. Epub 2010 Nov 4.

GFZ German Research Centre for Geosciences, Section 3.3, Telegrafenberg, 14473 Potsdam, Germany.

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http://pubs.acs.org/doi/abs/10.1021/jp101749h
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http://dx.doi.org/10.1021/jp101749hDOI Listing
December 2010

Integral modeling approach to study the phase behavior of complex solids: application to phase transitions in MgSiO3 pyroxenes.

Authors:
Sandro Jahn

Acta Crystallogr A 2010 Sep 12;66(Pt 5):535-41. Epub 2010 Aug 12.

Deutsches GeoForschungsZentrum GFZ, Telegrafenberg, 14471 Potsdam, Germany.

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http://dx.doi.org/10.1107/S0108767310026449DOI Listing
September 2010

Condensed phase ionic polarizabilities from plane wave density functional theory calculations.

J Chem Phys 2006 Oct;125(14):144104

Chemistry Department, University of Edinburgh, Edinburgh EH9 3JJ, United Kingdom.

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http://dx.doi.org/10.1063/1.2357151DOI Listing
October 2006

Atomic dynamics in liquids with competing interactions.

Phys Rev Lett 2004 May 5;92(18):185507. Epub 2004 May 5.

Institute of Physics, Materials Research and Liquids, TU Chemnitz, 09107 Chemnitz, Germany.

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http://dx.doi.org/10.1103/PhysRevLett.92.185507DOI Listing
May 2004

Multipoles and interaction potentials in ionic materials from planewave-DFT calculations.

Faraday Discuss 2003 ;124:171-84; discussion 205-13, 453-5

Physical and Theoretical Chemistry Laboratory, University of Oxford, South Parks Road, Oxford, UK OX1 3QZ.

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http://dx.doi.org/10.1039/b300319cDOI Listing
October 2003