검색결과 : 79건
| No. | Article |
|---|---|
| 1 |
Charge Transfer Processes for H + H-2(+) Reaction Employing Coupled 3D Wavepacket Approach on Beyond Born-Oppenheimer Based Ab Initio Constructed Diabatic Potential Energy Surfaces Ghosh S, Sahoo T, Baer M, Adhikari S Journal of Physical Chemistry A, 125(3), 731, 2021 |
| 2 |
Isotope Effects in the Resonant Inelastic Soft X-ray Scattering Maps of Gas-Phase Methanol Benkert A., Meyer F., Hauschild D., Blum M., Yang W., Wilks R. G., Baer M., Reinert F., Heske C., Weinhardt L. Journal of Physical Chemistry A, 120(14), 2260, 2016 |
| 3 |
Dressed Adiabatic and Diabatic Potentials To Study Topological Effects for F + H-2 Csehi A, Bende A, Hallasz GJ, Vibok A, Das A, Mukhopadhyay D, Mukherjee S, Adhikari S, Baer M Journal of Physical Chemistry A, 118(33), 6361, 2014 |
| 4 |
Identifying Residual Structure in Intrinsically Disordered Systems: A 2D IR Spectroscopic Study of the GVGXPGVG Peptide Lessing J, Roy S, Reppert M, Baer M, Marx D, Jansen TL, Knoester J, Tokmakoff A Journal of the American Chemical Society, 134(11), 5032, 2012 |
| 5 |
Derivation of diabatic potentials for F + H-2 employing non-adiabatic coupling terms Das A, Mukhopadhyay D, Adhikari S, Baer M Chemical Physics Letters, 517(1-3), 92, 2011 |
| 6 |
Molecular Symmetry Properties of Conical Intersections and Nonadiabatic Coupling Terms: Theory and Quantum Chemical Demonstration for Cyclopenta-2,4-dienimine (C5H4NH) Al-Jabour S, Baer M, Deeb O, Leibscher M, Manz J, Xu X, Zilberg S Journal of Physical Chemistry A, 114(9), 2991, 2010 |
| 7 |
Interpreting Vibrational Sum-Frequency Spectra of Sulfur Dioxide at the Air/Water Interface: A Comprehensive Molecular Dynamics Study Baer M, Mundy CJ, Chang TM, Tao FM, Dang LX Journal of Physical Chemistry B, 114(21), 7245, 2010 |
| 8 |
Intralines of Quasi-Conical Intersections on Torsion Planes: Methylamine as a Case Study Levi C, Halasz GJ, Vibok A, Bar I, Zeiri Y, Kosloff R, Baer M Journal of Physical Chemistry A, 113(24), 6756, 2009 |
| 9 |
No Confinement Needed: Observation of a Metastable Hydrophobic Wetting Two-Layer Ice on Graphene Kimmel GA, Matthiesen J, Baer M, Mundy CJ, Petrik NG, Smith RS, Dohnalek Z, Kay BD Journal of the American Chemical Society, 131(35), 12838, 2009 |
| 10 |
Space-time contours to treat the interaction between an intense electric field and a molecular system Baer M Journal of Physical Chemistry A, 110(20), 6571, 2006 |