المؤلفون: Salvitti G., Sigismondi S., Melandri S., López J. C., Blanco S., Maris A.

المساهمون: Salvitti G., Sigismondi S., Melandri S., López J.C., Blanco S., Maris A.

مصطلحات موضوعية: aminoacetophenone, large amplitude motions, rotational spectroscopy, quantum mechanical calculations, conformational space

وصف الملف: STAMPA

Relation: info:eu-repo/semantics/altIdentifier/pmid/38175733; info:eu-repo/semantics/altIdentifier/wos/WOS:001136509100001; volume:26; issue:3; firstpage:1881; lastpage:1890; numberofpages:10; journal:PHYSICAL CHEMISTRY CHEMICAL PHYSICS; https://hdl.handle.net/11585/955405; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85181561656; https://pubs.rsc.org/en/content/articlelanding/2024/cp/d3cp05608b

الاتاحة: https://hdl.handle.net/11585/955405
https://doi.org/10.1039/d3cp05608b
https://pubs.rsc.org/en/content/articlelanding/2024/cp/d3cp05608b

المؤلفون: Moradian Khadijeh, Raghebi Mahdi, Sheikholeslami Tahereh Fanaei

المصدر: FME Transactions, Vol 50, Iss 1, Pp 64-71 (2022)

مصطلحات موضوعية: ms-emg, impact, polyurethane, large-amplitude motions, energy harvester, environment vibrations, Engineering (General). Civil engineering (General), TA1-2040, Mechanics of engineering. Applied mechanics, TA349-359

وصف الملف: electronic resource

Relation: https://scindeks-clanci.ceon.rs/data/pdf/1451-2092/2022/1451-20922201064M.pdf; https://doaj.org/toc/1451-2092; https://doaj.org/toc/2406-128X

URL الوصول: https://doaj.org/article/24e4e2bb71e24ddfbf5e09d355980de8

المؤلفون: Nguyen, Ha Vinh Lam, Caminati, Walther, Grabow, Jens-Uwe

المساهمون: Laboratoire Interuniversitaire des Systèmes Atmosphériques (LISA (UMR_7583)), Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Centre National de la Recherche Scientifique (CNRS)-Université Paris Cité (UPCité), ANR-18-CE29-0011,PARIS-FTMW,Un nouveau spectromètre microonde par transformée de Fourier et jet moléculaire combinant un résonateur et un chirp pulsé pour enregistrer rapidement des spectres à haute résolution et discriminer des énantiomères(2018)

المصدر: ISSN: 1420-3049 ; Molecules ; https://hal.science/hal-04245804 ; Molecules, 2022, 27 (12), pp.3948. ⟨10.3390/molecules27123948⟩.

مصطلحات موضوعية: rotational spectroscopy, aromatic rings, internal rotation, inversion tunneling, coupled large amplitude motions, [CHIM]Chemical Sciences, [PHYS]Physics [physics]

الاتاحة: https://hal.science/hal-04245804
https://hal.science/hal-04245804v1/document
https://hal.science/hal-04245804v1/file/Ring%20review.pdf
https://doi.org/10.3390/molecules27123948

المؤلفون: Maris A., Favero L. B., Song W., Lv D., Evangelisti L., Melandri S.

المساهمون: Maris A., Favero L.B., Song W., Lv D., Evangelisti L., Melandri S.

مصطلحات موضوعية: Biosignatures, dimethylsulphoxide, interstellar medium, isotopologues, large amplitude motions, millimetre wave spectroscopy, molecular structure, planetary atmospheres

وصف الملف: STAMPA

Relation: info:eu-repo/semantics/altIdentifier/wos/WOS:000839958900001; volume:21; issue:5; firstpage:405; lastpage:422; numberofpages:18; journal:INTERNATIONAL JOURNAL OF ASTROBIOLOGY; https://hdl.handle.net/11585/905677; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85139126350; https://www.cambridge.org/core/journals/international-journal-of-astrobiology/article/searching-for-biosignatures-by-their-rotational-spectrum-global-fit-and-methyl-group-internal-rotation-features-of-dimethylsulphoxide-up-to-116-ghz/2A6D1E3B3E9EB33E5248623D631A0088

الاتاحة: https://hdl.handle.net/11585/905677
https://doi.org/10.1017/S1473550422000271
https://www.cambridge.org/core/journals/international-journal-of-astrobiology/article/searching-for-biosignatures-by-their-rotational-spectrum-global-fit-and-methyl-group-internal-rotation-features-of-dimethylsulphoxide-up-to-116-ghz/2A6D1E3B3E9EB33E5248623D631A0088

المؤلفون: Lynn Ferres, Luca Evangelisti, Assimo Maris, Sonia Melandri, Walther Caminati, Wolfgang Stahl, Ha Vinh Lam Nguyen

المصدر: Molecules; Volume 27; Issue 9; Pages: 2730

مصطلحات موضوعية: internal rotation, large amplitude motions, skeletal motion tunneling, rotational spectroscopy

جغرافية الموضوع: agris

وصف الملف: application/pdf

Relation: Physical Chemistry; https://dx.doi.org/10.3390/molecules27092730

الاتاحة: https://doi.org/10.3390/molecules27092730

المؤلفون: Nguyen, Ha Vinh Lam, Kleiner, Isabelle

المساهمون: Laboratoire Interuniversitaire des Systèmes Atmosphériques (LISA (UMR_7583)), Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Centre National de la Recherche Scientifique (CNRS)-Université Paris Cité (UPCité), Institut universitaire de France (IUF), Ministère de l'Education nationale, de l’Enseignement supérieur et de la Recherche (M.E.N.E.S.R.), ANR-18-CE29-0011,PARIS-FTMW,Un nouveau spectromètre microonde par transformée de Fourier et jet moléculaire combinant un résonateur et un chirp pulsé pour enregistrer rapidement des spectres à haute résolution et discriminer des énantiomères(2018)

المصدر: ISSN: 2365-6581.

مصطلحات موضوعية: microwave spectroscopy, rotational spectroscopy, large amplitude motions, conformational analysis, spectral fitting, molecular jet Fourier transform, [CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry

الاتاحة: https://hal.u-pec.fr/hal-03182535
https://hal.u-pec.fr/hal-03182535v1/document
https://hal.u-pec.fr/hal-03182535v1/file/Book%20chapter_HAL.pdf
https://doi.org/10.1515/psr-2020-0037

المؤلفون: Silva, Weslley G. D. P., van Wijngaarden, Jennifer

مصطلحات موضوعية: microwave spectroscopy, non-covalent interactions, quantum chemistry calculations, microsolvation, quantum tunneling, large amplitude motions

وصف الملف: application/pdf

Relation: Silva, W. G. D. P.; van Wijngaarden, J. Characterization of Large-Amplitude Motions and Hydrogen Bonding Interactions in the Thiophene–Water Complex by Rotational Spectroscopy. J. Phys. Chem. A 2021, 125, 16, 3425–3431; http://hdl.handle.net/1993/36042

الاتاحة: http://hdl.handle.net/1993/36042
https://doi.org/10.1021/acs.jpca.1c02086

المؤلفون: Ujjayini Ghosh (1578778), David P. Weliky (1344474)

مصطلحات موضوعية: Biophysics, Biochemistry, Microbiology, Cell Biology, Science Policy, Infectious Diseases, Virology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, pH 5, influenza, lipid acyl chains, large-amplitude motions, pH 7, antiparallel β sheet structure, membrane fusion intermediates, temperature dependence, 7. GPfp, membrane-enveloped virus, perdeuterated DMPC membrane, R 2 CD 2, 2 H NMR, HAfp, chain location, membrane liquid-crystalline-to-gel ., fusion catalysis, Catalyze Membrane Fusion, Bound Viral Fusion Peptide, vesicle fusion, nonhomologous HIV

Relation: https://figshare.com/articles/journal_contribution/Rapid_sup_2_sup_H_NMR_Transverse_Relaxation_of_Perdeuterated_Lipid_Acyl_Chains_of_Membrane_with_Bound_Viral_Fusion_Peptide_Supports_Large-Amplitude_Motions_of_These_Chains_That_Can_Catalyze_Membrane_Fusion/16455494

الاتاحة: https://doi.org/10.1021/acs.biochem.1c00316.s001

المؤلفون: Safa Khemissi (11472599), Arnau Pérez Salvador (11472602), Ha Vinh Lam Nguyen (8422764)

مصطلحات موضوعية: Biophysics, Biochemistry, Molecular Biology, Neuroscience, Pharmacology, Plant Biology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, several hundred mhz, quantum chemical calculations, large amplitude motions, barrier heights observed, rotational energy levels, steric effects failing, >- methyl group, two isomers 2, steric effects, methyl group, six isomers, different levels, methyl groups, electrostatic effects, torsional barriers, recorded using, position seems, ortho <, microwave spectrum, meta <, internal rotations, frequency range

Relation: https://figshare.com/articles/journal_contribution/Large_Amplitude_Motions_in_2_3-Dimethylfluorobenzene_Steric_Effects_Failing_to_Interpret_Hindered_Methyl_Torsion/16671059

الاتاحة: https://doi.org/10.1021/acs.jpca.1c05093.s001

المؤلفون: Bowei Wu (6390503), Arsh S. Hazrah (6706331), Nathan A. Seifert (1464706), Sönke Oswald (1811530), Wolfgang Jäger (1363677), Yunjie Xu (793634)

مصطلحات موضوعية: Biophysics, Biochemistry, Sociology, Marine Biology, Inorganic Chemistry, Space Science, Environmental Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, transform microwave spectrometer, one previously reported, oh ··· h, chirped pulse fourier, 5 kj mol, water tunneling splitting, water preferentially stabilizes, isopropanol ··· water, amplitude water motions, relative energy difference, large amplitude motions, 1 kj mol, hfip ··· water, >, global minimum configuration, 2015 ,, water motion, >, monomer configuration, energy correction, 119 ,<, sub ><

Relation: https://figshare.com/articles/journal_contribution/Higher-Energy_Hexafluoroisopropanol_Water_Isomer_and_Its_Large_Amplitude_Motions_Rotational_Spectra_and_DFT_Calculations/17100088

الاتاحة: https://doi.org/10.1021/acs.jpca.1c09058.s001

المؤلفون: Van, Vinh, Nguyen, Thuy, Stahl, Wolfgang, Lam Nguyen, Ha Vinh, Kleiner, Isabelle

المساهمون: RWTH Aachen University = Rheinisch-Westfälische Technische Hochschule Aachen (RWTH Aachen), Laboratoire Interuniversitaire des Systèmes Atmosphériques (LISA (UMR_7583)), Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Centre National de la Recherche Scientifique (CNRS)-Université Paris Cité (UPCité), Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12), ANR-18-CE29-0011,PARIS-FTMW,Un nouveau spectromètre microonde par transformée de Fourier et jet moléculaire combinant un résonateur et un chirp pulsé pour enregistrer rapidement des spectres à haute résolution et discriminer des énantiomères(2018)

المصدر: ISSN: 0022-2860.

مصطلحات موضوعية: internal rotation, large amplitude motions, quadrupole hyperfine structure, rotational spectroscopy, dimethylthiazole, [CHIM]Chemical Sciences, [PHYS]Physics [physics]

الاتاحة: https://hal.science/hal-03410650
https://hal.science/hal-03410650v1/document
https://hal.science/hal-03410650v1/file/1-s2.0-S0022286020301113-am-paper-for-HAL.pdf
https://doi.org/10.1016/j.molstruc.2020.127787

المؤلفون: Denis Tikhonov (10578248)

مصطلحات موضوعية: Theory - Computational, Quantum Mechanics, Spectroscopy (Physical Chem.), tunneling splitting, effective Hamiltonian, large amplitude motions, formic acid dimer, malonaldehyde

Relation: https://figshare.com/articles/preprint/Accurate_Tunneling_Splittings_for_Proton_Transfer_in_Malonaldehyde_and_Formic_Acid_Dimer_Using_the_One-Dimensional_Schr_dinger_Equation/14394080

الاتاحة: https://doi.org/10.26434/chemrxiv.14394080.v2

المؤلفون: Gyawali, Prakash

المساهمون: R. Motiyenko, Laboratoire de Physique des Lasers, Atomes et Molécules - UMR 8523 PhLAM

مصطلحات موضوعية: spectroscopie d’ondes mm/sub-mm, mouvements de grande amplitude, haute résolution, rotation interne, complexe à faible liaison, impulsion de jet, impulsion chirpée, mm/sub-mm wave spectroscopy, large-amplitude motions, highresolution, internal rotation, weakly bounded complex, pulse jet, chirped pulse

وصف الملف: application/octet-stream

Relation: Ecole Doctorale Sciences de la Matière, du Rayonnement et de l’Environnement (EDSMRE); http://hdl.handle.net/20.500.12210/116681

الاتاحة: https://hdl.handle.net/20.500.12210/116681

المؤلفون: Gyawali, Prakash

المساهمون: Laboratoire de Physique des Lasers, Atomes et Molécules - UMR 8523 (PhLAM), Université de Lille-Centre National de la Recherche Scientifique (CNRS), Lille University, R. Motiyenko

المصدر: https://theses.hal.science/tel-04685461 ; Physics [physics]. Lille University, 2023. English. ⟨NNT : ⟩.

مصطلحات موضوعية: mm/sub-mm wave spectroscopy, large-amplitude motions, highresolution, internal rotation, weakly bounded complex, pulse jet, chirped pulse, spectroscopie d’ondes mm/sub-mm, mouvements de grande amplitude, haute résolution, rotation interne, complexe à faible liaison, impulsion de jet, impulsion chirpée, [PHYS]Physics [physics], [PHYS.PHYS.PHYS-OPTICS]Physics [physics]/Physics [physics]/Optics [physics.optics]

Relation: tel-04685461; https://theses.hal.science/tel-04685461; https://theses.hal.science/tel-04685461/document; https://theses.hal.science/tel-04685461/file/Thesis_Prakash_Gyawali_PhLAM.pdf

الاتاحة: https://theses.hal.science/tel-04685461
https://theses.hal.science/tel-04685461/document
https://theses.hal.science/tel-04685461/file/Thesis_Prakash_Gyawali_PhLAM.pdf

المؤلفون: Xia, Yiyin, Koenis, Mark A J, Collados, Juan F, Ortiz, Pablo, Harutyunyan, Syuzanna R, Visscher, Lucas, Buma, Wybren J, Nicu, Valentin P

المصدر: Xia , Y , Koenis , M A J , Collados , J F , Ortiz , P , Harutyunyan , S R , Visscher , L , Buma , W J & Nicu , V P 2018 , ' Regional Susceptibility in VCD Spectra to Dynamic Molecular Motions : The Case of a Benzyl α-Hydroxysilane ' , Chemphyschem , vol. 19 , no. 5 , pp. 561-565 . https://doi.org/10.1002/cphc.201701335

مصطلحات موضوعية: configuration determination, conformations analysis, density functional theory, vibrational circular dichroism, vibrational spectroscopy, VIBRATIONAL CIRCULAR-DICHROISM, COUPLED OSCILLATOR MECHANISM, LARGE-AMPLITUDE MOTIONS, CORRELATION-ENERGY, FORCE-FIELD, OLD CONCEPT, APPROXIMATION, MODEL, IMPLEMENTATION

وصف الملف: application/pdf

Relation: https://research.rug.nl/en/publications/29bbd446-f589-45e1-b42d-827aa4a26d9e

الاتاحة: https://hdl.handle.net/11370/29bbd446-f589-45e1-b42d-827aa4a26d9e
https://research.rug.nl/en/publications/29bbd446-f589-45e1-b42d-827aa4a26d9e
https://doi.org/10.1002/cphc.201701335
https://pure.rug.nl/ws/files/64031126/Xia_et_al_2018_ChemPhysChem.pdf

المؤلفون: Hernandez-Castillo, Alicia, O, Abeysekera, Chamara, Hays, Brian, Kleiner, Isabelle, Nguyen, Ha Vinh Lam, Zwier, Timothy, S

المساهمون: Purdue University West Lafayette, Laboratoire Interuniversitaire des Systèmes Atmosphériques (LISA (UMR_7583)), Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris Diderot - Paris 7 (UPD7)-Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Centre National de la Recherche Scientifique (CNRS)

المصدر: ISSN: 0022-2852.

مصطلحات موضوعية: methyl butyrate, rotational spectroscopy, large amplitude motions, conformational analysis, [CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry

Relation: hal-03183101; https://hal.science/hal-03183101; https://hal.science/hal-03183101/document; https://hal.science/hal-03183101/file/BME_HAL.pdf

الاتاحة: https://hal.science/hal-03183101
https://hal.science/hal-03183101/document
https://hal.science/hal-03183101/file/BME_HAL.pdf
https://doi.org/10.1016/j.jms.2017.03.016

المؤلفون: Maris, Assimo, Melandri, Sonia, Evangelisti, Luca, Vigorito, Annalisa, Sigismondi, Silvia, Calabrese, Camilla, Usabiaga, Imanol

المساهمون: Ministero dell'Istruzione, dell'Università e della Ricerca, Università di Bologna

مصطلحات موضوعية: Amide, Gas-phase structure, Large amplitude motions, Nuclear quadrupole hyperfine structure, Rotational spectroscopy, Quantum mechanical calculations

وصف الملف: application/pdf

Relation: https://doi.org/10.1016/j.molstruc.2021.131391; Sí; Journal of Molecular Structure 1248: 131391 (2022); http://hdl.handle.net/10261/296568

الاتاحة: http://hdl.handle.net/10261/296568
https://doi.org/10.1016/j.molstruc.2021.131391

المؤلفون: Assimo Maris, Silvia Sigismondi, Luca Evangelisti, Sonia Melandri, Imanol Usabiaga, Annalisa Vigorito, Camilla Calabrese

المساهمون: Ministero dell'Istruzione, dell'Università e della Ricerca, Università di Bologna, Maris A., Melandri S., Evangelisti L., Vigorito A., Sigismondi S., Calabrese C., Usabiaga I.

مصطلحات موضوعية: Amide, Rotational spectroscopy, Quantum mechanical calculations, Large amplitude motion, Organic Chemistry, Dihedral angle, Large amplitude motions, Analytical Chemistry, Inorganic Chemistry, chemistry.chemical_compound, Crystallography, Nuclear quadrupole hyperfine structure, chemistry, Quantum mechanical calculation, Intramolecular force, Methacrylamide, Gas-phase structure, Absorption (chemistry), Conformational isomerism, Isomerization, Spectroscopy, Quantum tunnelling

وصف الملف: application/pdf; STAMPA

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c904ea45430593a8ea1240f63a10518c
http://hdl.handle.net/10261/296568

المؤلفون: Koziol, Kenneth Jan

المساهمون: Nguyen, Ha Vinh Lam, Lüchow, Arne

المصدر: Aachen : RWTH Aachen University Online-Ressource : Illustrationen, Diagramme (2022). doi:10.18154/RWTH-2023-03681 = Dissertation, RWTH Aachen University, 2022

مصطلحات موضوعية: large amplitude motions, quantum chemistry, rotational spectroscopy, ddc:540, quadrupole coupling, molecular dynamics, microwave spectroscopy

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::25aadb5321cae2471fc0d2f8abcead05

المؤلفون: Dindic, Christina

مصطلحات موضوعية: internal rotation, large amplitude motions, microwave spectroscopy, rotational spectroscopy, quantum chemistry

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::9ccc5ba07ee7ca61a806715a3acf0d51