Theo dơi
Marcel Baer
Marcel Baer
Scientist, PNNL
Email được xác minh tại pnnl.gov
Tiêu đề
Trích dẫn bởi
Trích dẫn bởi
Năm
No confinement needed: Observation of a metastable hydrophobic wetting two-layer ice on graphene
GA Kimmel, J Matthiesen, M Baer, CJ Mundy, NG Petrik, RS Smith, ...
Journal of the American Chemical Society 131 (35), 12838-12844, 2009
2202009
Simulation and theory of ions at atmospherically relevant aqueous liquid-air interfaces
DJ Tobias, AC Stern, MD Baer, Y Levin, CJ Mundy
Annual review of physical chemistry 64 (1), 339-359, 2013
1932013
Highly stable and self-repairing membrane-mimetic 2D nanomaterials assembled from lipid-like peptoids
H Jin, F Jiao, MD Daily, Y Chen, F Yan, YH Ding, X Zhang, EJ Robertson, ...
Nature communications 7 (1), 12252, 2016
1562016
Supersaturated calcium carbonate solutions are classical
K Henzler, EO Fetisov, M Galib, MD Baer, BA Legg, C Borca, JM Xto, ...
Science advances 4 (1), eaao6283, 2018
1542018
Toward an understanding of the specific ion effect using density functional theory
MD Baer, CJ Mundy
The Journal of Physical Chemistry Letters 2 (9), 1088-1093, 2011
1492011
Revisiting the hydration structure of aqueous Na+
M Galib, MD Baer, LB Skinner, CJ Mundy, T Huthwelker, GK Schenter, ...
The Journal of chemical physics 146 (8), 2017
1362017
Tuning crystallization pathways through sequence engineering of biomimetic polymers
X Ma, S Zhang, F Jiao, CJ Newcomb, Y Zhang, A Prakash, Z Liao, ...
Nature materials 16 (7), 767-774, 2017
1352017
Toward a unified picture of the water self-ions at the air–water interface: A density functional theory perspective
MD Baer, IFW Kuo, DJ Tobias, CJ Mundy
The Journal of Physical Chemistry B 118 (28), 8364-8372, 2014
1172014
Polarization- and Azimuth-Resolved Infrared Spectroscopy of Water on TiO2(110): Anisotropy and the Hydrogen-Bonding Network
GA Kimmel, M Baer, NG Petrik, J VandeVondele, R Rousseau, CJ Mundy
The journal of physical chemistry letters 3 (6), 778-784, 2012
1122012
Re-examining the properties of the aqueous vapor–liquid interface using dispersion corrected density functional theory
MD Baer, CJ Mundy, MJ McGrath, IFW Kuo, JI Siepmann, DJ Tobias
The Journal of chemical physics 135 (12), 2011
1032011
Probing the hydration structure of polarizable halides: a multiedge XAFS and molecular dynamics study of the iodide anion
JL Fulton, GK Schenter, MD Baer, CJ Mundy, LX Dang, ...
The Journal of Physical Chemistry B 114 (40), 12926-12937, 2010
1012010
The role of broken symmetry in solvation of a spherical cavity in classical and quantum water models
RC Remsing, MD Baer, GK Schenter, CJ Mundy, JD Weeks
The journal of physical chemistry letters 5 (16), 2767-2774, 2014
932014
Electrochemical surface potential due to classical point charge models drives anion adsorption to the air–water interface
MD Baer, AC Stern, Y Levin, DJ Tobias, CJ Mundy
The Journal of Physical Chemistry Letters 3 (11), 1565-1570, 2012
892012
Does nitric acid dissociate at the aqueous solution surface?
T Lewis, B Winter, AC Stern, MD Baer, CJ Mundy, DJ Tobias, ...
The Journal of Physical Chemistry C 115 (43), 21183-21190, 2011
892011
Is iodate a strongly hydrated cation?
MD Baer, VT Pham, JL Fulton, GK Schenter, M Balasubramanian, ...
The Journal of Physical Chemistry Letters 2 (20), 2650-2654, 2011
812011
Real single ion solvation free energies with quantum mechanical simulation
TT Duignan, MD Baer, GK Schenter, CJ Mundy
Chemical Science 8 (9), 6131-6140, 2017
782017
Marcus theory of ion-pairing
S Roy, MD Baer, CJ Mundy, GK Schenter
Journal of chemical theory and computation 13 (8), 3470-3477, 2017
712017
Persistent ion pairing in aqueous hydrochloric acid
MD Baer, JL Fulton, M Balasubramanian, GK Schenter, CJ Mundy
The Journal of Physical Chemistry B 118 (26), 7211-7220, 2014
702014
Thermodynamics of iodide adsorption at the instantaneous air-water interface
AC Stern, MD Baer, CJ Mundy, DJ Tobias
The Journal of chemical physics 138 (11), 2013
672013
Mass density fluctuations in quantum and classical descriptions of liquid water
M Galib, TT Duignan, Y Misteli, MD Baer, GK Schenter, J Hutter, ...
The Journal of chemical physics 146 (24), 2017
622017
Hệ thống không thể thực hiện thao tác ngay bây giờ. Hăy thử lại sau.
Bài viết 1–20