עקוב אחר
Quan Wan
Quan Wan
Graduate student, The University of Chicago
כתובת אימייל מאומתת בדומיין uchicago.edu
כותרת
צוטט על ידי
צוטט על ידי
שנה
Raman Spectra of Liquid Water from Ab Initio Molecular Dynamics: Vibrational Signatures of Charge Fluctuations in the Hydrogen Bond Network
Q Wan, L Spanu, GA Galli, F Gygi
Journal of chemical theory and computation 9 (9), 4124-4130, 2013
982013
The refractive index and electronic gap of water and ice increase with increasing pressure
D Pan, Q Wan, G Galli
Nature communications 5 (1), 3919, 2014
822014
First-principles framework to compute sum-frequency generation vibrational spectra of semiconductors and insulators
Q Wan, G Galli
Physical Review Letters 115 (24), 246404, 2015
542015
Solvation Properties of Microhydrated Sulfate Anion Clusters: Insights from abInitio Calculations
Q Wan, L Spanu, G Galli
The Journal of Physical Chemistry B 116 (31), 9460-9466, 2012
272012
Electronic structure of aqueous sulfuric acid from first-principles simulations with hybrid functionals
Q Wan, L Spanu, F Gygi, G Galli
The Journal of Physical Chemistry Letters 5 (15), 2562-2567, 2014
262014
Ab initio Raman spectroscopy of water under extreme conditions
V Rozsa, D Pan, Q Wan, G Galli
APS March Meeting Abstracts 2016, K21. 001, 2016
2016
Sum grequency generation spectroscopy from first principles
Q Wan, G Galli
APS March Meeting Abstracts 2015, G24. 006, 2015
2015
Sum frequency generation spectra of ice surfaces from first principles simulations
Q Wan, F Gygi, G Galli
APS March Meeting Abstracts 2014, L27. 004, 2014
2014
Vibrational spectroscopy of liquid water from first principles simulations: Raman Spectra
Q Wan, L Spanu, G Galli, F Gygi
APS March Meeting Abstracts 2013, M24. 007, 2013
2013
Structural and vibrational properties of sulphate-water clusters from ab-initio calculations
Q Wan, L Spanu, G Galli
APS March Meeting Abstracts 2012, H35. 011, 2012
2012
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מאמרים 1–10