المؤلفون: Noah R. Garrett, Megan C. Davis, Ryan C. Fortenberry

مصطلحات موضوعية: Biophysics, Medicine, Biotechnology, Physical Sciences not elsewhere classified, vibrational perturbation theory, sup >+, state computations grows, quartic force field, perturbative triples levels, gas phase molecules, consistently accurate results, anharmonic vibrational frequencies, anharmonic terms become, targeted excited states, quartic force constants, excited electronic states, electronically excited states, cost comparison improves, computational cost compared, rotational constants, cost savings, work shows, vpt2 ), variational treatments, test set, small selection, second order, rovibronic hamiltonian, roughly one, requiring less

Relation: https://figshare.com/articles/journal_contribution/DFT_F12_QFFs_for_Cost-Effective_Rovibrational_Spectral_Data_Predictions_of_Ground_and_Excited_Electronic_States/25012705

الاتاحة: https://doi.org/10.1021/acs.jctc.3c01179.s001
https://figshare.com/articles/journal_contribution/DFT_F12_QFFs_for_Cost-Effective_Rovibrational_Spectral_Data_Predictions_of_Ground_and_Excited_Electronic_States/25012705

المؤلفون: N. P. Boroznina, I. V. Zaporotskova, P. A. Zaporotskov, L. V. Kozhitov, D. R. Erofeev, Н. П. Борознина, И. В. Запороцкова, П. А. Запороцков, Л. В. Кожитов, Д. Р. Ерофеев

المصدر: Izvestiya Vysshikh Uchebnykh Zavedenii. Materialy Elektronnoi Tekhniki = Materials of Electronics Engineering; Том 25, № 4 (2022); 261-270 ; Известия высших учебных заведений. Материалы электронной техники; Том 25, № 4 (2022); 261-270 ; 2413-6387 ; 1609-3577 ; 10.17073/1609-3577-2022-4

مصطلحات موضوعية: ацетон, edge modification, functional nitro group, sensor activity, sorption properties, gas-phase molecules, carbon dioxide, acetone, краевое модифицирование, функциональная нитрогруппа, сенсорная активность, сорбционные свойства, газофазные молекулы, углекислый газ

وصف الملف: application/pdf

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Physica B: Condensed Matter. 2012; 407(17): 3646—3653. https://doi.org/10.1016/j.physb.2012.05.043; Ghorbanpour A.A., Roudbari M.A. Nonlocal piezoelastic surface effect on the vibration of visco-Pasternak coupled boron nitride nanotube system under a moving nanoparticle. Thin Solid Films. 2013; 542: 232—241. https://doi.org/10.1016/j.tsf.2013.06.025; Ghorbanpour A.A., Hafizi B.A., Ravandi K.A., Roudbari M.A., Amir S., Azizkhani M.B. Induced nonlocal electric wave propagation of boron nitride nanotubes. Journal of Mechanical Science and Technology. 2013; 27: 3063—3071. https://doi.org/10.1007/s12206-013-0705-7; Ghorbanpour A.A., Roudbari M.A. Surface stress, initial stress and Knudsen-dependent flow velocity effects on the electro-thermo nonlocal wave propagation of SWBNNTs. Physica B: Condensed Matter. 2014; 452: 159—165. https://doi.org/10.1016/j.physb.2014.07.017; Ghorbanpour A.A., Jalilvand A., Ghaffari M., Talebi M.M., Kolahchi R, Roudbari M.A., Amir S. Nonlinear pull-in instability of boron nitride nano-switches considering electrostatic and Casimir forces. Scientia Iranica. 2014; 21(3): 1183—1196.; Ghorbanpour A.A., Karamali R.A., Roudbari M.A., Azizkhani M.B., Bidgoli A. Axial and transverse vibration of SWBNNT system coupled Pasternak foundation under a moving nanoparticle using Timoshenko beam theory. Journal of Solid Mechanics. 2015; 7(3): 239—254.; Ansari R., Rouhi S., Mirnezhad M., Aryayi M. Stability characteristics of single-walled boron nitride nanotubes. Archives of Civil and Mechanical Engineering. 2015; 15: 162—170. https://doi.org/10.1016/J.ACME.2014.01.008; Ciofani G., Danti S., D’Alessandro D., Moscato S., Menciassi A. Assessing cytotoxicity of boron nitride nanotubes: interference with the MTT assay. Biochemical and Biophysical Research Communications. 2010; 394(2): 405—411. https://doi.org/10.1016/j.bbrc.2010.03.035; Chowdhury R., Wang C.Y., Adhikari S., Scarpa F. 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الاتاحة: https://met.misis.ru/jour/article/view/503
https://doi.org/10.17073/1609-3577-2022-4-261-270

المؤلفون: Carlström, Stefanos, Spanner, Michael, Patchkovskii, Serguei

مصطلحات موضوعية: Ionization of gases, Lithium compounds, Quantum chemistry, Configuration interaction singles, Equation of motion, Gas phase molecules, General equations, Grid-based, Spherical symmetry, Strong field ionization, Time dependent, Equations of motion

Time: 530

وصف الملف: application/pdf

الاتاحة: https://oa.tib.eu/renate/handle/123456789/10783
https://doi.org/10.34657/9809

المؤلفون: Agustín J. Colussi (1274643), Shinichi Enami (1270776), Shinnosuke Ishizuka (3346631)

مصطلحات موضوعية: Biophysics, Biochemistry, Infectious Diseases, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, p K, density OTL water, acids H 3 O, Hydronium Ion Acidity, acidic, H 3 O, ion, Surface-specific experiments show, TMA, ISO, H 2 O, protonated bases BH, acidity, gas-phase molecules, pH 4 microdroplets, Aqueous Microdroplets Atmospheric cloud

Relation: https://figshare.com/articles/journal_contribution/Hydronium_Ion_Acidity_Above_and_Below_the_Interface_of_Aqueous_Microdroplets/16440861

الاتاحة: https://doi.org/10.1021/acsearthspacechem.1c00067.s001

المؤلفون: Svärd, Michael, Rasmuson, Åke C.

المصدر: Industrial & Engineering Chemistry Research. 48(6):2899-2912

مصطلحات موضوعية: Chemical engineers, Compass force fields, Critical assessments, Crystalline compounds, Dreiding force fields, Electrostatic potentials, Force field methods, Force fields, Gas-phase molecules, Geometry optimizations, Hf/6-31g, In process, Industrial chemists, Integral charges, Lattice energies, Linear correlations, Molecular geometries, Molecular simulations, Order of magnitudes, Organic molecules, Point charges, Potential energy hyper surfaces, Specialty chemicals, Standard methods, Structure modeling, TECHNOLOGY, Chemical engineering, TEKNIKVETENSKAP, Kemiteknik

وصف الملف: electronic

URL الوصول: https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-10496
https://kth.diva-portal.org/smash/get/diva2:218128/FULLTEXT01.pdf

المؤلفون: Boll, R., Rouzée, A., Adolph, M., Anielski, D., Aquila, A., Bari, S., Bomme, C., Bostedt, C., Bozek, J.D., Chapman, H.N., Christensen, L., Coffee, R., Coppola, N., De, S., Decleva, P., Epp, S.W., Erk, B., Filsinger, F., Foucar, L., Gorkhover, T., Gumprecht, L., Hömke, A., Holmegaard, L., Johnsson, P., Kienitz, J.S., Kierspel, T., Krasniqi, F., Kühnel, K.-U., Maurer, J., Messerschmidt, M., Moshammer, R., Müller, N.L.M., Rudek, B., Savelyev, E., Schlichting, I., Schmidt, C., Scholz, F., Schorb, S., Schulz, J., Seltmann, J., Stener, M., Stern, S., Techert, S., Thøgersen, J., Trippel, S., Viefhaus, J., Vrakking, M., Stapelfeldt, H., Küpper, J., Ullrich, J., Rudenko, A., Rolles, D.

مصطلحات موضوعية: femtosecond time-resolved photoelectron diffraction, gas-phase molecules, optical laser, X-ray free-electron laser

Time: 540

وصف الملف: application/pdf

الاتاحة: https://doi.org/10.34657/4446
https://oa.tib.eu/renate/handle/123456789/5817

المؤلفون: Keane, JV, Boonman, AMS, Tielens, AGGM, van Dishoeck, EF, Dishoeck, E. F., Lahuis, F. van, Wright, C. M., Doty, S. D.

المصدر: Keane , JV , Boonman , AMS , Tielens , AGGM , van Dishoeck , EF , Dishoeck , E F , Lahuis , F V , Wright , C M & Doty , S D 2001 , ' Gas-phase SO2 in absorption towards massive protostars ' , Astronomy & Astrophysics , vol. 376 , no. 1 , pp. L5-L8 . https://doi.org/10.1051/0004-6361:20011008

مصطلحات موضوعية: star-formation : gas-phase molecules, ISM : abundances, ISM : molecules, YOUNG STELLAR OBJECTS, INTERSTELLAR CLOUDS, DENSE CLOUDS, HOT CORES, MOLECULES, CHEMISTRY, SULFUR, OMC-1, SPECTROSCOPY, EVOLUTION

وصف الملف: application/pdf

Relation: https://research.rug.nl/en/publications/c5b1516a-f5e3-4bfc-b597-bb3db4146995

الاتاحة: https://hdl.handle.net/11370/c5b1516a-f5e3-4bfc-b597-bb3db4146995
https://research.rug.nl/en/publications/c5b1516a-f5e3-4bfc-b597-bb3db4146995
https://doi.org/10.1051/0004-6361:20011008
https://pure.rug.nl/ws/files/6664562/gas-phase_H2O.pdf

المؤلفون: Ablikim, Utuq, Bomme, Cédric, Osipov, Timur, Xiong, Hui, Obaid, Razib, Bilodeau, René C., Kling, Nora G., Dumitriu, Ileana, Augustin, Sven, Pathak, Shashank, Schnorr, Kirsten, Kilcoyne, David, Berrah, Nora, Rolles, Daniel

مصطلحات موضوعية: inner-shell photoionization, velocity map, spectrometer, gas-phase molecules

وصف الملف: application/pdf

Relation: https://doi.org/10.1063/1.5093420; https://hdl.handle.net/2097/40678

الاتاحة: https://hdl.handle.net/2097/40678

المؤلفون: Dimitrios Rompotis, Daniel Rolles, Rebecca Boll, Bastian Manschwetus, Benjamin Erk

المصدر: JoVE 140, e57055 (2018). doi:10.3791/57055
Journal of Visualized Experiments : JoVE

مصطلحات موضوعية: Free electron model, Pump-probe experiments, Photochemistry, General Chemical Engineering, Jitter correction, Physics::Optics, Electrons, Temporal and spatial overlap, Issue 140, 01 natural sciences, General Biochemistry, Genetics and Molecular Biology, 010305 fluids & plasmas, law.invention, Flash (photography), Optics, law, Free-electron lasers, ddc:570, 0103 physical sciences, Atomic and molecular physics, 010306 general physics, Jitter, General Immunology and Microbiology, business.industry, Lasers, General Neuroscience, Laser, Chemistry, Gas-phase molecules, Extreme ultraviolet, Temporal resolution, Femtosecond, Femtosecond lasers, business, Ultrashort pulse

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::12a9168b45e5293f6cfa3f6d6f4aa555
https://doi.org/10.3791/57055

المؤلفون: Jan Rothhardt, Steffen Hädrich, Yariv Shamir, Maxim Tschnernajew, Robert Klas, Armin Hoffmann, Getnet K. Tadesse, Arno Klenke, Thomas Gottschall, Tino Eidam, Jens Limpert, Andreas Tünnermann, Rebecca Boll, Cedric Bomme, Hatem Dachraoui, Benjamin Erk, Michele Di Fraia, Daniel A. Horke, Thomas Kierspel, Terence Mullins, Andreas Przystawik, Evgeny Savelyev, Joss Wiese, Tim Laarmann, Jochen Küpper, Daniel Rolles

مصطلحات موضوعية: Cell Biology, Physiology, Immunology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, Visualization, probe-beam, scanning, High-repetition-rate, 08 August 2016, Optics Express, delay, coincidence ion imaging, high-photon-flux 70 eV high-harmonic source, gas-phase molecules Inteference fringes, oe

Relation: https://figshare.com/articles/media/Visualization_1_High-repetition-rate_and_high-photon-flux_70_eV_high-harmonic_source_for_coincidence_ion_imaging_of_gas-phase_molecules/4949858

الاتاحة: https://doi.org/10.1364/oe.24.018133.v001
https://figshare.com/articles/media/Visualization_1_High-repetition-rate_and_high-photon-flux_70_eV_high-harmonic_source_for_coincidence_ion_imaging_of_gas-phase_molecules/4949858

المؤلفون: Reeve, Scott W., Allen, Susan Davis

المصدر: Susan D Allen

مصطلحات موضوعية: patent, multi-color ringdown-based spectrometer detection method, detect presence of gas phase molecules from explosives, drugs, hazardous materials, a subject’s breath skin or bodily fluid, Mechanical Engineering

Relation: https://works.bepress.com/susan_davis_allen/6

الاتاحة: https://works.bepress.com/susan_davis_allen/6

المؤلفون: Reeve, Scott W., Allen, Susan Davis

المساهمون: allens17

المصدر: Mechanical Engineering - Daytona Beach

مصطلحات موضوعية: patent, multi-color ringdown-based spectrometer detection method, detect presence of gas phase molecules from explosives, drugs, hazardous materials, a subject’s breath skin or bodily fluid, Mechanical Engineering

وصف الملف: application/pdf

Relation: https://commons.erau.edu/db-mechanical-engineering/16; https://commons.erau.edu/context/db-mechanical-engineering/article/1015/viewcontent/8237927_allen_patent_2012.pdf

الاتاحة: https://commons.erau.edu/db-mechanical-engineering/16
https://commons.erau.edu/context/db-mechanical-engineering/article/1015/viewcontent/8237927_allen_patent_2012.pdf

المؤلفون: Reeve, Scott, Allen, Susan

المساهمون: allens17

المصدر: Mechanical Engineering - Daytona Beach

مصطلحات موضوعية: patent, multi-color ringdown-based spectrometer detection method, detect presence of gas phase molecules from explosives, drugs, hazardous materials, Mechanical Engineering

وصف الملف: application/pdf

Relation: https://commons.erau.edu/db-mechanical-engineering/14; https://commons.erau.edu/context/db-mechanical-engineering/article/1013/viewcontent/7768647_allen_patent_2010.pdf

الاتاحة: https://commons.erau.edu/db-mechanical-engineering/14
https://commons.erau.edu/context/db-mechanical-engineering/article/1013/viewcontent/7768647_allen_patent_2010.pdf

المؤلفون: Åke C. Rasmuson, Michael Svärd

مصطلحات موضوعية: p-aminobenzoic acid, Standard methods, Structure modeling, General Chemical Engineering, Hf/6-31g, Nanotechnology, Crystal structure, Molecular mechanics, Industrial and Manufacturing Engineering, Force field (chemistry), Dreiding force fields, Molecular dynamics, Molecular geometries, Crystalline compounds, Kemiteknik, Molecule, Specialty chemicals, In process, Statistical physics, Compass force fields, Order of magnitudes, small organic molecules, Geometry optimizations, Force field methods, Electrostatic potentials, Chemistry, business.industry, Force fields, Integral charges, millimeter wave spectrum, Potential energy hyper surfaces, General Chemistry, Chemical Engineering, Work in process, Point charges, structure prediction, Chemical engineers, Critical assessments, molecular electrostatic potentials, Gas-phase molecules, Lattice energies, New product development, atomic charges, Molecular simulations, Linear correlations, Industrial chemists, Organic molecules, business, Speciality chemicals

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f405015cba1d9276ae9b3561d62e0015

المؤلفون: Dimopoulos, Georgina

Thesis Advisors: Terlouw, Johan K., Chemistry

مصطلحات موضوعية: mass, spectrometry, computational, elusive, organic, ions, neutral, gas, phase, molecules, energy

الاتاحة: http://hdl.handle.net/11375/19269

المؤلفون: allens17, Reeve, Scott W., Allen, Susan Davis

المصدر: Mechanical Engineering - Daytona Beach

مصطلحات الفهرس: patent, multi-color ringdown-based spectrometer detection method, detect presence of gas phase molecules from explosives, drugs, hazardous materials, a subject’s breath skin or bodily fluid, Mechanical Engineering, text

URL: https://commons.erau.edu/db-mechanical-engineering/16
https://commons.erau.edu/context/db-mechanical-engineering/article/1015/viewcontent/8237927_allen_patent_2012.pdf

المؤلفون: allens17, Reeve, Scott, Allen, Susan

المصدر: Mechanical Engineering - Daytona Beach

مصطلحات الفهرس: patent, multi-color ringdown-based spectrometer detection method, detect presence of gas phase molecules from explosives, drugs, hazardous materials, Mechanical Engineering, text

URL: https://commons.erau.edu/db-mechanical-engineering/14
https://commons.erau.edu/context/db-mechanical-engineering/article/1013/viewcontent/7768647_allen_patent_2010.pdf