CP2K Open Source Molecular Dynamics

User Tools

Site Tools

Trace:
science

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision		Previous revision
Next revisionBoth sides next revision
science [2020/05/13 09:12] – jglanscience [2021/01/05 08:50] – tkuehne
Line 1: Line 1:
 ~~NOTOC~~ ~~NOTOC~~
 +===== Condensed Phase Infrared Spectroscopy of Organic Phosphates =====
 +
 +Prasanth B. Ganta, Oliver Kühn, and Ashour A. Ahmed; 2021; Ab Initio Molecular Dynamics Simulations of the Interaction between Organic Phosphates and Goethite. 
 +[[ doi>https://doi.org/10.3390/molecules26010160 | Molecules 2021, 26, 1, 160 ]]
 +
 ===== Nuclear Quantum Efffects at Metal Interfaces ===== ===== Nuclear Quantum Efffects at Metal Interfaces =====
  
Line 5: Line 10:
  
 Jinggang Lan, Vladimir V. Rybkin, and Marcella Iannuzzi; 2020; Ionization of water as an effect of quantum delocalization at aqueous electrode interfaces. Jinggang Lan, Vladimir V. Rybkin, and Marcella Iannuzzi; 2020; Ionization of water as an effect of quantum delocalization at aqueous electrode interfaces.
-[[ https://doi.org/10.1021/acs.jpclett.0c01025 | J. Phys. Chem. Lett. 2020, 11, 9, 3724-3730 ]]+[[ doi>https://doi.org/10.1021/acs.jpclett.0c01025 | J. Phys. Chem. Lett. 2020, 11, 9, 3724-3730 ]]
  
 ===== C.U.R.A.T.E.D. COFs ===== ===== C.U.R.A.T.E.D. COFs =====
science.txt · Last modified: 2024/03/21 19:56 by jglan