Molecular beam scattering of ammonia from a dodecane flat liquid jet

Saric, Steven; Yang, Walt; Neumark, Daniel M.

doi:10.1039/d3fd00169e

Molecular beam scattering of ammonia from a dodecane flat liquid jet

Journal Article · Fri May 17 00:00:00 EDT 2024 · Faraday Discussions

DOI:https://doi.org/10.1039/d3fd00169e· OSTI ID:2370372

^[1]; ^[1]; ^[1]

Univ. of California, Berkeley, CA (United States); Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

The evaporation and scattering of ND₃ from a dodecane flat liquid jet are investigated and the results are compared with previous studies on molecular beam scattering from liquid surfaces. Evaporation is well-described by a Maxwell–Boltzmann flux distribution with a cos θ angular distribution at the liquid temperature. Scattering experiments at E_i = 28.8 kJ mol^-1 over a range of deflection angles show evidence for impulsive scattering and thermal desorption. Further, at a deflection angle of 90°, the thermal desorption fraction is 0.49, which is higher than that of other molecules previously scattered from dodecane and consistent with work performed on NH₃ scattering from a squalane-wetted wheel. ND₃ scattering from dodecane results in super-specular scattering, as seen in previous experiments on dodecane. The impulsive scattering channel is fitted to a “soft-sphere” model, yielding an effective surface mass of 55 amu and an internal excitation of 5.08 kJ mol^-1. Overall, impulsively scattered ND₃ behaves similarly to other small molecules scattered from dodecane.

View Accepted Manuscript (DOE)

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division (CSGB)

Grant/Contract Number:: AC02-05CH11231

OSTI ID:: 2370372

Alternate ID(s):: OSTI ID: 2352335

Journal Information:: Faraday Discussions, Journal Name: Faraday Discussions Vol. 251; ISSN 1359-6640

Publisher:: Royal Society of ChemistryCopyright Statement

Country of Publication:: United States

Language:: English

References (51)

Quantum chemical study of the umbrella inversion of the ammonia molecule Ghosh, Dulal C.; Jana, Jibanananda; Biswas, Raka International Journal of Quantum Chemistry, Vol. 80, Issue 1 https://doi.org/10.1002/1097-461X(2000)80:1<1::AID-QUA1>3.0.CO;2-D	journal	January 2000
Ueber die Anwendung des Satzes vom Virial in der kinetischen Theorie der Gase Lorentz, H. A. Annalen der Physik, Vol. 248, Issue 1 https://doi.org/10.1002/andp.18812480110	journal	January 1881
Molecular Beam Studies of Elementary Chemical Processes(Nobel Lecture) Lee, Yuan Tseh Angewandte Chemie International Edition in English, Vol. 26, Issue 10 https://doi.org/10.1002/anie.198709393	journal	October 1987
A novel mechanism for the isomerization of N ₂ O ₄ and its implication for the reaction with H ₂ O and acid rain formation Putikam, Raghunath; Lin, Ming-Chang International Journal of Quantum Chemistry, Vol. 118, Issue 12 https://doi.org/10.1002/qua.25560	journal	December 2017
Laser Sustained Plasma Free Jet and Energetic Atom Beam of Pure Argon or Oxygen Seeded Argon Mixture Lebéhot, A.; Kurzyna, J.; Lago, V. Atomic and Molecular Beams https://doi.org/10.1007/978-3-642-56800-8_15	book	January 2001
A molecular beam study of the evaporation of water from a liquid jet Faubel, M.; Schlemmer, S.; Toennies, J. P. Zeitschrift f�r Physik D Atoms, Molecules and Clusters, Vol. 10, Issue 2-3 https://doi.org/10.1007/BF01384861	journal	June 1988
Incident energy dependence of the scattering dynamics of water molecules on silicon and graphite surfaces: the effect on tangential momentum accommodation Kinefuchi, Ikuya; Kotsubo, Yusuke; Osuka, Kenichi Microfluidics and Nanofluidics, Vol. 21, Issue 2 https://doi.org/10.1007/s10404-017-1850-6	journal	January 2017
Molecular beam scattering from solid surfaces Weinberg, W. Henry Advances in Colloid and Interface Science, Vol. 4, Issue 4 https://doi.org/10.1016/0001-8686(75)85007-X	journal	February 1975
Direct-inelastic and trapping-desorption scattering of N2 and CH4 from Pt(111) Janda, Kenneth C.; E. Hurst, Jerry; Cowin, James Surface Science, Vol. 130, Issue 2 https://doi.org/10.1016/0039-6028(83)90369-2	journal	August 1983
Molecular beam scattering from solid surfaces: He diffraction, hyperthermal scattering, and surface dynamics Cardillo, Mark J. Surface Science, Vol. 299-300 https://doi.org/10.1016/0039-6028(94)90660-2	journal	January 1994
Gas—surface interactions and dynamics; Thermal energy atomic and molecular beam studies Barker, J. A.; Auerbach, D. J. Surface Science Reports, Vol. 4, Issue 1-2 https://doi.org/10.1016/0167-5729(84)90005-0	journal	January 1984
A numerical molecular potential for the umbrella inversion in ammonia Letelier, J. Spectrochimica Acta Part A: Molecular Spectroscopy, Vol. 53, Issue 2 https://doi.org/10.1016/S0584-8539(97)81437-7	journal	February 1997
Evaporation and Molecular Beam Scattering from a Flat Liquid Jet Lee, Chin; Pohl, Marvin N.; Ramphal, Isaac A. The Journal of Physical Chemistry A, Vol. 126, Issue 21 https://doi.org/10.1021/acs.jpca.2c01174	journal	May 2022
Inelastic Scattering of CN Radicals at the Gas–Liquid Interface Probed by Frequency-Modulated Absorption Spectroscopy Lane, Paul D.; Moncrieff, Katya E.; Greaves, Stuart J. The Journal of Physical Chemistry C, Vol. 124, Issue 30 https://doi.org/10.1021/acs.jpcc.0c04023	journal	July 2020
Molecular Bonding and Interactions at Aqueous Surfaces as Probed by Vibrational Sum Frequency Spectroscopy Richmond, G. L. Chemical Reviews, Vol. 102, Issue 8 https://doi.org/10.1021/cr0006876	journal	August 2002
Photoemission from Liquid Aqueous Solutions Winter, Bernd; Faubel, Manfred Chemical Reviews, Vol. 106, Issue 4 https://doi.org/10.1021/cr040381p	journal	April 2006
SOLUBILITIES OF WATER IN SEVERAL NORMAL ALKANES FROM C₇ TO C₁₆¹ Schatzberg, Paul The Journal of Physical Chemistry, Vol. 67, Issue 4 https://doi.org/10.1021/j100798a014	journal	April 1963
A New Mechanism of Acid Rain Generation from HOSO at the Air–Water Interface Ruiz-López, Manuel F.; Martins-Costa, Marilia T. C.; Anglada, Josep M. Journal of the American Chemical Society, Vol. 141, Issue 42 https://doi.org/10.1021/jacs.9b07912	journal	October 2019
Solubility of Gases in Liquids. 20. Solubility of He, Ne, Ar, Kr, N₂, O₂, CH₄, CF₄, and SF₆inn-Alkanesn-C_lH₂_l₊₂(6 ≤l≤ 16) at 298.15 K Hesse, Paul J.; Battino, Rubin; Scharlin, Pirketta Journal of Chemical & Engineering Data, Vol. 41, Issue 2 https://doi.org/10.1021/je9502455	journal	January 1996
On the Full Topology of the Laplacian of the Electron Density II: Umbrella Inversion of the Ammonia Molecule Malcolm, Nathaniel O. J.; Popelier, Paul L. A. The Journal of Physical Chemistry A, Vol. 105, Issue 32 https://doi.org/10.1021/jp0113937	journal	July 2001
Toward Three-Dimensional Quantum State-Resolved Collision Dynamics at the Gas−Liquid Interface: Theoretical Investigation of Incident Angle Perkins, Bradford G.; Nesbitt, David J. The Journal of Physical Chemistry A, Vol. 113, Issue 16 https://doi.org/10.1021/jp811322y	journal	March 2009
Scattering Dynamics of Hyperthermal Oxygen Atoms on Ionic Liquid Surfaces: [emim][NTf ₂ ] and [C ₁₂ mim][NTf ₂ ] Wu, Bohan; Zhang, Jianming; Minton, Timothy K. The Journal of Physical Chemistry C, Vol. 114, Issue 9 https://doi.org/10.1021/jp910641s	journal	March 2010
Dynamics and Kinetics at the Gas−Liquid Interface Nathanson, Gilbert M.; Davidovits, Paul; Worsnop, Douglas R. The Journal of Physical Chemistry, Vol. 100, Issue 31 https://doi.org/10.1021/jp953548e	journal	January 1996
Effects of Thermal Roughening on the Angular Distributions of Trapping and Scattering in Gas−Liquid Collisions King, Mackenzie E.; Fiehrer, Kathleen M.; Nathanson, Gilbert M. The Journal of Physical Chemistry A, Vol. 101, Issue 36 https://doi.org/10.1021/jp970761x	journal	September 1997
Metrics to assess the mitigation of global warming by carbon capture and storage in the ocean and in geological reservoirs Haugan, Peter M. Geophysical Research Letters, Vol. 31, Issue 18 https://doi.org/10.1029/2004GL020295	journal	January 2004
Non-equilibrium molecular evaporation of carboxylic acid dimers Faubel, M.; Kisters, Th Nature, Vol. 339, Issue 6225 https://doi.org/10.1038/339527a0	journal	June 1989
Generation and characterization of ultrathin free-flowing liquid sheets Koralek, Jake D.; Kim, Jongjin B.; Brůža, Petr Nature Communications, Vol. 9, Issue 1 https://doi.org/10.1038/s41467-018-03696-w	journal	April 2018
Microjets and coated wheels: versatile tools for exploring collisions and reactions at gas–liquid interfaces Faust, Jennifer A.; Nathanson, Gilbert M. Chemical Society Reviews, Vol. 45, Issue 13 https://doi.org/10.1039/C6CS00079G	journal	January 2016
A critical analysis of electrospray techniques for the determination of accelerated rates and mechanisms of chemical reactions in droplets Rovelli, Grazia; Jacobs, Michael I.; Willis, Megan D. Chemical Science, Vol. 11, Issue 48 https://doi.org/10.1039/D0SC04611F	journal	January 2020
Molecular beam studies of HCl dissolution and dissociation in cold salty water Brastad, Susan M.; Nathanson, Gilbert M. Physical Chemistry Chemical Physics, Vol. 13, Issue 18 https://doi.org/10.1039/c0cp02540b	journal	January 2011
Kinematics and dynamics of atomic-beam scattering on liquid and self-assembled monolayer surfaces Alexander, William A.; Zhang, Jianming; Murray, Vanessa J. Faraday Discussions, Vol. 157 https://doi.org/10.1039/c2fd20034a	journal	January 2012
Reactive scattering Herschbach, D. R. Faraday Discussions of the Chemical Society, Vol. 55 https://doi.org/10.1039/dc9735500233	journal	January 1973
Velocity distribution measurements of 0.06–1.4 eV argon and neon atoms scattered from the (111) plane of a silver crystal Subbarao, R. B.; Miller, D. R. The Journal of Chemical Physics, Vol. 58, Issue 12 https://doi.org/10.1063/1.1679137	journal	June 1973
Molecular Beam Reactive Scattering Apparatus with Electron Bombardment Detector Lee, Y. T.; McDonald, J. D.; LeBreton, P. R. Review of Scientific Instruments, Vol. 40, Issue 11 https://doi.org/10.1063/1.1683809	journal	November 1969
A short pulse (7 μs FWHM) and high repetition rate (dc-5kHz) cantilever piezovalve for pulsed atomic and molecular beams Irimia, Daniel; Dobrikov, Dimitar; Kortekaas, Rob Review of Scientific Instruments, Vol. 80, Issue 11 https://doi.org/10.1063/1.3263912	journal	November 2009
Molecular beam studies of the F+H ₂ reaction Neumark, D. M.; Wodtke, A. M.; Robinson, G. N. The Journal of Chemical Physics, Vol. 82, Issue 7 https://doi.org/10.1063/1.448254	journal	April 1985
Effect of incidence kinetic energy and surface coverage on the dissociative chemisorption of oxygen on W(110) Rettner, C. T.; DeLouise, L. A.; Auerbach, D. J. The Journal of Chemical Physics, Vol. 85, Issue 2 https://doi.org/10.1063/1.451310	journal	July 1986
Crossed molecular beams study of the reaction D+H ₂ →DH+H at collision energies of 0.53 and 1.01 eV Continetti, R. E.; Balko, B. A.; Lee, Y. T. The Journal of Chemical Physics, Vol. 93, Issue 8 https://doi.org/10.1063/1.459566	journal	October 1990
Collisions of protic and aprotic gases with hydrogen bonding and hydrocarbon liquids Saecker, Mary E.; Nathanson, Gilbert M. The Journal of Chemical Physics, Vol. 99, Issue 9 https://doi.org/10.1063/1.465425	journal	November 1993
Measurement of the density profile of pure and seeded molecular beams by femtosecond ion imaging Meng, Congsen; Janssen, Maurice H. M. Review of Scientific Instruments, Vol. 86, Issue 2 https://doi.org/10.1063/1.4913251	journal	February 2015
Sub- and super-Maxwellian evaporation of simple gases from liquid water Kann, Z. R.; Skinner, J. L. The Journal of Chemical Physics, Vol. 144, Issue 15 https://doi.org/10.1063/1.4945625	journal	April 2016
Molecular dynamics investigation of energy transfer during gas-surface collisions Andric, Nemanja; Jenny, Patrick Physics of Fluids, Vol. 30, Issue 7 https://doi.org/10.1063/1.5037783	journal	July 2018
Evaporation and scattering of neon, methane, and water from a dodecane flat liquid jet Yang, Walt; Lee, Chin; Saric, Steven The Journal of Chemical Physics, Vol. 159, Issue 5 https://doi.org/10.1063/5.0159796	journal	August 2023
Observation of Direct Inelastic Scattering in the Presence of Trapping-Desorption Scattering: Xe on Pt(111) Hurst, J. E.; Becker, C. A.; Cowin, J. P. Physical Review Letters, Vol. 43, Issue 16 https://doi.org/10.1103/PhysRevLett.43.1175	journal	October 1979
Observation of a Soliton Reconstruction of Au(111) by High-Resolution Helium-Atom Diffraction Harten, U.; Lahee, A. M.; Toennies, J. Peter Physical Review Letters, Vol. 54, Issue 24 https://doi.org/10.1103/PhysRevLett.54.2619	journal	June 1985
Probing the microscopic corrugation of liquid surfaces with gas-liquid collisions King, Mackenzie E.; Nathanson, Gilbert M.; Hanning-Lee, Mark Physical Review Letters, Vol. 70, Issue 7 https://doi.org/10.1103/PhysRevLett.70.1026	journal	February 1993
Molecular Beam Scattering from Liquid Surfaces Saecker, Mary E.; Govoni, Steven T.; Kowalski, Daniel V. Science, Vol. 252, Issue 5011 https://doi.org/10.1126/science.252.5011.1421	journal	June 1991
Vibrational Promotion of Electron Transfer Huang, Y. Science, Vol. 290, Issue 5489 https://doi.org/10.1126/science.290.5489.111	journal	October 2000
A critical evaluation of Lennard–Jones and Stockmayer potential parameters and of some correlation methods Mourits, Frank M.; Rummens, Frans H. A. Canadian Journal of Chemistry, Vol. 55, Issue 16 https://doi.org/10.1139/v77-418	journal	August 1977
Molecular beam Studies of Gas-Liquid Interfaces Nathanson, Gilbert M. Annual Review of Physical Chemistry, Vol. 55, Issue 1 https://doi.org/10.1146/annurev.physchem.55.091602.094357	journal	June 2004
Mutual Solubilities of Some Hydrocarbon Oils and Liquid Ammonia. I. Solubility Data Ishida, Kiyoharu Bulletin of the Chemical Society of Japan, Vol. 31, Issue 2 https://doi.org/10.1246/bcsj.31.143	journal	February 1958

Similar Records

Evaporation and scattering of neon, methane, and water from a dodecane flat liquid jet

Journal Article · Wed Aug 02 00:00:00 EDT 2023 · Journal of Chemical Physics · OSTI ID:2294052

Molecular beam scattering of neon from flat jets of cold salty water

Journal Article · Wed Jun 25 00:00:00 EDT 2025 · Chemical Science · OSTI ID:2570840

Molecular beam scattering from flat jets of liquid dodecane and water

Journal Article · Sat Jun 01 00:00:00 EDT 2024 · Natural Sciences · OSTI ID:2568337

Related Subjects

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

Molecular beam scattering of ammonia from a dodecane flat liquid jet

Citation Formats

References (51)

Similar Records

Related Subjects