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Acta Crystallographica. Section A, Foundations of Crystallography
|
August 20, 2010
Integral modeling approach to study the phase behavior of complex solids: application to phase transitions in MgSiO3 pyroxenes
Sandro Jahn
The Journal of Physical Chemistry. B
|
November 6, 2010
Speciation in aqueous MgSO(4) fluids at high pressures and high temperatures from ab initio molecular dynamics and Raman spectroscopy
Sandro Jahn, Christian Schmidt
The Journal of Physical Chemistry. A
|
July 8, 2026
Vibrational and Structural Properties of Aqueous H<sub>2</sub>SO<sub>4</sub> and Na<sub>2</sub>SO<sub>4</sub> Systems from Ambient to Supercritical Conditions: A Comparative Study between GGA(-D3) and r2SCAN Functionals
Rajorshi Chattopadhyay, Sandro Jahn
Physical Review Letters
|
June 1, 2004
Atomic dynamics in liquids with competing interactions
Sandro Jahn, Jens-Boie Suck
Physical Chemistry Chemical Physics : PCCP
|
August 14, 2018
Aqueous sodium hydroxide (NaOH) solutions at high pressure and temperature: insights from in situ Raman spectroscopy and ab initio molecular dynamics simulations
Johannes Stefanski, Christian Schmidt, Sandro Jahn
The Journal of Chemical Physics
|
April 24, 2012
Vibrational mode frequencies of silica species in SiO2-H2O liquids and glasses from ab initio molecular dynamics
Georg Spiekermann, Matthew Steele-MacInnis, Christian Schmidt, et al.
Faraday Discussions
|
October 7, 2003
Multipoles and interaction potentials in ionic materials from planewave-DFT calculations
Andrés Aguado, Leonardo Bernasconi, Sandro Jahn, et al.
The Journal of Chemical Physics
|
October 18, 2006
Condensed phase ionic polarizabilities from plane wave density functional theory calculations
Robert J Heaton, Paul A Madden, Stewart J Clark, et al.
The Journal of Chemical Physics
|
November 7, 2012
Vibrational mode frequencies of H4SiO4, D4SiO4, H6Si2O7, and H6Si3O9 in aqueous environment, obtained from ab initio molecular dynamics
Georg Spiekermann, Matthew Steele-MacInnis, Piotr M Kowalski, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
September 7, 2017
Beyond sixfold coordinated Si in SiO<sub>2</sub> glass at ultrahigh pressures
Clemens Prescher, Vitali B Prakapenka, Johannes Stefanski, et al.
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Showing results (1-10 of 23) with videos related to
Sort By:
Page
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Acta Crystallographica. Section A, Foundations of Crystallography
|
August 20, 2010
Integral modeling approach to study the phase behavior of complex solids: application to phase transitions in MgSiO3 pyroxenes
Sandro Jahn
The Journal of Physical Chemistry. B
|
November 6, 2010
Speciation in aqueous MgSO(4) fluids at high pressures and high temperatures from ab initio molecular dynamics and Raman spectroscopy
Sandro Jahn, Christian Schmidt
The Journal of Physical Chemistry. A
|
July 8, 2026
Vibrational and Structural Properties of Aqueous H<sub>2</sub>SO<sub>4</sub> and Na<sub>2</sub>SO<sub>4</sub> Systems from Ambient to Supercritical Conditions: A Comparative Study between GGA(-D3) and r2SCAN Functionals
Rajorshi Chattopadhyay, Sandro Jahn
Physical Review Letters
|
June 1, 2004
Atomic dynamics in liquids with competing interactions
Sandro Jahn, Jens-Boie Suck
Physical Chemistry Chemical Physics : PCCP
|
August 14, 2018
Aqueous sodium hydroxide (NaOH) solutions at high pressure and temperature: insights from in situ Raman spectroscopy and ab initio molecular dynamics simulations
Johannes Stefanski, Christian Schmidt, Sandro Jahn
The Journal of Chemical Physics
|
April 24, 2012
Vibrational mode frequencies of silica species in SiO2-H2O liquids and glasses from ab initio molecular dynamics
Georg Spiekermann, Matthew Steele-MacInnis, Christian Schmidt, et al.
Faraday Discussions
|
October 7, 2003
Multipoles and interaction potentials in ionic materials from planewave-DFT calculations
Andrés Aguado, Leonardo Bernasconi, Sandro Jahn, et al.
The Journal of Chemical Physics
|
October 18, 2006
Condensed phase ionic polarizabilities from plane wave density functional theory calculations
Robert J Heaton, Paul A Madden, Stewart J Clark, et al.
The Journal of Chemical Physics
|
November 7, 2012
Vibrational mode frequencies of H4SiO4, D4SiO4, H6Si2O7, and H6Si3O9 in aqueous environment, obtained from ab initio molecular dynamics
Georg Spiekermann, Matthew Steele-MacInnis, Piotr M Kowalski, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
September 7, 2017
Beyond sixfold coordinated Si in SiO<sub>2</sub> glass at ultrahigh pressures
Clemens Prescher, Vitali B Prakapenka, Johannes Stefanski, et al.
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of 3