State-to-state resolved differential cross sections for rotationally inelastic scattering of ND3 with He
Literature Information
Ondřej Tkáč, Ashim Kumar Saha, Jolijn Onvlee, Chung-Hsin Yang, Gautam Sarma, Chandan Kumar Bishwakarma, Sebastiaan Y. T. van de Meerakker, Ad van der Avoird, David H. Parker, Andrew J. Orr-Ewing
State-to-state differential cross sections are reported for rotationally inelastic scattering of fully state-selected ND3 (jk± = 11−) with He. Experimental measurements are compared with full close-coupling quantum-mechanical scattering calculations that used an ab initio potential energy surface. Results are presented for final states up to j′k′ ± = 77− at a mean collision energy of 430 cm−1. For selected final quantum states, the effect of collision energy on the differential cross sections is also explored in the range 230–720 cm−1. For the experimental studies, a hexapole electrostatic lens was used for the jk± state-selection of ND3 molecules in their electronic and vibrational ground states in a molecular beam. This state-selected molecular beam was then crossed with a beam of He atoms. The velocities of inelastically scattered ND3 molecules in single j′k′ ± states were obtained by velocity map imaging, and converted to differential cross sections in the centre-of-mass frame by density-to-flux transformation. The close-coupling calculations reproduce well the measured angular distributions. For small changes in the rotational angular momentum quantum number (j), the ND3 is predominantly forward scattered, but the scattering shifts to the sideways and backward directions as Δj increases. For scattering into a given j′k′ ± state, cross-sections for collisions that conserve the ± symmetry associated with the ND3 inversion vibration are larger and generally more forward scattered than the corresponding symmetry-changing processes.
Recommended Journals
Related Literature
Recent advances in copper chalcogenides for CO2 electroreduction
Didier Grandjean, Ewald Janssens
DOI: 10.1039/D3CP04170K
Two-dimensional AlN/TMO van der Waals heterojunction as a promising photocatalyst for water splitting driven by visible light
Ji Tao, Can Li, Shixian Xiong, Zhiqiang Xu, Jingyao Shao, Lei Cao, Ying Zhang, Kejun Dong, Ling-Ling Wang
DOI: 10.1039/D3CP04120D
The boson peak in silicate glasses: insight from molecular dynamics
Ahmed El Hamdaoui, El Mehdi Ghardi, Achraf Atila, Michael Badawi, Abdellatif Hasnaoui, Said Ouaskit
DOI: 10.1039/D3CP02912C
Kinetics of metal detection by luminescence-based whole-cell biosensors: connecting biosensor response to metal bioavailability, speciation and cell metabolism
Jérôme F. L. Duval, Lorenzo Maffei, Eva Delatour, Marie Zaffino, Christophe Pagnout
DOI: 10.1039/D3CP04653B
Substituted tetrazoles with N-oxide moiety: critical assessment of thermochemical properties
Dmitry V. Khakimov, Tatyana S. Pivina
DOI: 10.1039/D3CP05144G
Impact of a rubrene buffer layer on the dynamic magnetic behavior of nickel layers on Si(100)
Ranganadha Gopalarao Tanguturi, Jian-Chen Tsai, You-Siang Li, Jyh-Shen Tsay
DOI: 10.1039/D3CP04463G
Covalently bonded interface in polymer/boron nitride nanosheet composite toward enhanced mechanical and thermal behaviour
Ankur Chaurasia, Kaushlendra Kumar, S. P. Harsha, Avinash Parashar
DOI: 10.1039/D3CP04497A
Molecular mechanisms underlying nanowire formation in pristine phthalocyanine
Aadil Pinjari, Deepashri Saraf
DOI: 10.1039/D3CP03512C
The inhibitory effect of excess calcium ions on the polymerization process of calcium aluminate silicate hydrate (CASH) gel
Dongshuai Hou, Mengqi Sun, Muhan Wang, Zheng Chen, Xinpeng Wang, Yue Zhang, Pan Wang
DOI: 10.1039/D3CP03266C
Theoretical study of protein adsorption on graphene/h-BN heterostructures
Jun Lan, Yiran Peng, Lijun Liang, Xing Duan, Zhe Kong, Li Zhang
DOI: 10.1039/D3CP03303A
You might also like
How should 2-Methylbenzene-1,4-diamine dihydrochloride (CAS: 615-45-2) be stored?
2-Methylbenzene-1,4-diamine dihydrochloride (CAS: 615-45-2) should be stored in ...
Is (1S,4S)-2,5-Diazabicyclo[2.2.1]heptane dihydrobromide (CAS: 132747-20-7) safe?
(1S,4S)-2,5-Diazabicyclo[2.2.1]heptane dihydrobromide is generally considered sa...
What industries use (6-Chloropyridazin-3-YL)methanamine (CAS: 871826-15-2)?
(6-Chloropyridazin-3-YL)methanamine finds applications in the pharmaceutical ind...
What are the main uses of 2-Fluoro-3-methylphenol (CAS: 77772-72-6)?
2-Fluoro-3-methylphenol is primarily used in the synthesis of pharmaceuticals, p...
What precautions should be taken when handling 3-Methoxy-4-nitrobenzonitrile (CAS: 177476-75-4)?
When handling 3-Methoxy-4-nitrobenzonitrile, it is important to wear appropriate...
What precautions should be taken when handling 1,3-Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 211949-57-4)?
When handling 1,3-Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 211949-57-4), it is ...
What regulatory guidelines apply to 4-Ethynylbenzamide (CAS: 90347-86-7)?
4-Ethynylbenzamide (CAS: 90347-86-7) falls under various regulatory guidelines i...
What are the main uses of 3-(2-Ethylphenyl)-2-thioxo-4-imidazolidinone (CAS: 186822-57-1)?
3-(2-Ethylphenyl)-2-thioxo-4-imidazolidinone is primarily used as an intermediat...
What is (2-Fluoro-6-methoxyphenyl)acetic acid (CAS: 500912-19-6)?
(2-Fluoro-6-methoxyphenyl)acetic acid, also known as 4-fluoro-3-methoxybenzoic a...
What is the market or research trend for 2-[4-(Hydroxymethyl)phenoxy]ethanol (CAS: 102196-18-9)?
Market trends for 2-[4-(Hydroxymethyl)phenoxy]ethanol (CAS: 102196-18-9) indicat...
Source Journal
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.










![trans-2-{[(Tert-butoxy)carbonyl]amino}cyclobutane-1-carboxylic acid structure trans-2-{[(Tert-butoxy)carbonyl]amino}cyclobutane-1-carboxylic acid structure](https://static.chemtradehub.com/structs/951/951173-25-4-27cd.webp)



