يعرض 1 - 20 نتائج من 162,984 نتيجة بحث عن '"Atoms"', وقت الاستعلام: 0.64s تنقيح النتائج
  1. 1
    Academic Journal
    Atomic momentum distributions in polyatomic molecules in rotational–vibrational eigenstates.

    المؤلفون: Sakaguchi, Sota1 (AUTHOR), Ohshima, Yasuhiro1 (AUTHOR), Yamazaki, Masakazu1 (AUTHOR) yamazaki@chem.titech.ac.jp

    المصدر: Journal of Chemical Physics. 9/7/2024, Vol. 161 Issue 9, p1-12. 12p.

    مصطلحات موضوعية: *POLYATOMIC molecules, *ATOMS, *MOLECULES, *PROTONS, *OSCILLATIONS


    أضف إلى المفضلة
  2. 2
    Dissertation/ Thesis
    Anisotropic interactions and self-bound solutions in Bose-Einstein condensates

    المؤلفون: Arazo Sánchez, Maria

    المساهمون: University/Department: Universitat de Barcelona. Facultat de Física

    Thesis Advisors: Guilleumas, Montserrat, Mayol Sánchez, Ricardo, Soto Riera, Joan

    المصدر: TDX (Tesis Doctorals en Xarxa)

    مصطلحات موضوعية: Condensació de Bose-Einstein, Condensación de Bose-Einstein, Bose-Einstein condensation, Àtoms, Átomos, Atoms, Moments dipolars, Momentos dipolares, Dipole moments, Quiralitat, Quiralidad, Chirality, Camps de galga (Física), Campos de gauge (Física), Gauge fields (Physics), Ciències Experimentals i Matemàtiques

    وصف الملف: application/pdf

    URL الوصول: http://hdl.handle.net/10803/691180

    View record in TDX

    أضف إلى المفضلة
  3. 3
    Academic Journal
    Experimental molecular structures in the gas phase at the upper size limit: The case of Si6Tip6.

    المؤلفون: Vishnevskiy, Yury V.1 (AUTHOR) yury.vishnevskiy@uni-bielefeld.de, Heider, Yannic2 (AUTHOR), Scheschkewitz, David2 (AUTHOR)

    المصدر: Journal of Chemical Physics. 8/7/2024, Vol. 161 Issue 5, p1-7. 7p.

    مصطلحات موضوعية: *ATOMS in molecules theory, *MOLECULAR structure, *NATURAL orbitals, *ELECTRON gas, *APPROXIMATION theory


    أضف إلى المفضلة
  4. 4
    Academic Journal
    Modulation of the strength of weak S–H⋯O hydrogen-bond: Spectroscopic study of the complexes of 2-flurothiophenol with methanol and ethanol.

    المؤلفون: Metya, Surajit1 (AUTHOR), Roy, Supravat1 (AUTHOR), Mandal, Sourav1 (AUTHOR), Huang, Qian-Rui2 (AUTHOR), Kuo, Jer-Lai2 (AUTHOR) jlkuo@gate.sinica.edu.tw, Das, Aloke1 (AUTHOR) a.das@iiserpune.ac.in

    المصدر: Journal of Chemical Physics. 6/14/2024, Vol. 160 Issue 22, p1-14. 14p.

    مصطلحات موضوعية: *ATOMS in molecules theory, *NATURAL orbitals, *ETHANOL, *HYDROGEN bonding, *SULFHYDRYL group, *PROTON affinity


    أضف إلى المفضلة
  5. 5
    Dissertation/ Thesis
    Ultracold atoms in coupled ring potentials and flat-band lattices

    المؤلفون: Nicolau Jimenez, Eulalia

    Thesis Advisors: Ahufinger, Verònica

    المصدر: TDX (Tesis Doctorals en Xarxa)

    مصطلحات موضوعية: Àtoms ultrafreds, Ultracold atoms, Átomos ultrafríos, Moment angular orbital, Orbital angular momentum, Momento angular orbital, Termalització quàntica, Quantum thermalization, Termalización cuántica, Ciències Experimentals

    وصف الملف: application/pdf

    URL الوصول: http://hdl.handle.net/10803/691202

    View record in TDX

    أضف إلى المفضلة
  6. 6
    Academic Journal
    Symmetry breaking and self-interaction correction in the chromium atom and dimer.

    المؤلفون: Maniar, Rohan1 (AUTHOR), Withanage, Kushantha P. K.2 (AUTHOR), Shahi, Chandra1 (AUTHOR), Kaplan, Aaron D.3 (AUTHOR), Perdew, John P.1 (AUTHOR), Pederson, Mark R.2 (AUTHOR) mrpederson@utep.edu

    المصدر: Journal of Chemical Physics. 4/14/2024, Vol. 160 Issue 14, p1-9. 9p.

    مصطلحات موضوعية: *CHROMIUM, *ATOMS, *BINDING energy, *MAGNETIC moments, *CHEMICAL bond lengths, *SYMMETRY breaking


    أضف إلى المفضلة
  7. 7
    Academic Journal
    How electrons still guard the space: Electron number distribution functions based on QTAIM∩ELF intersections.

    المؤلفون: Barrena-Espés, Daniel1 (AUTHOR), Munárriz, Julen2 (AUTHOR) julen@unizar.es, Martín Pendás, Ángel1 (AUTHOR) ampendas@uniovi.es

    المصدر: Journal of Chemical Physics. 4/14/2024, Vol. 160 Issue 14, p1-17. 17p.

    مصطلحات موضوعية: *ELECTRON distribution, *ATOMS in molecules theory, *DISTRIBUTION (Probability theory), *ELECTRON density, *ELECTRONS


    أضف إلى المفضلة
  8. 8
    Academic Journal
    Extending the definition of atomic basis sets to atoms with fractional nuclear charge.

    المؤلفون: Domenichini, Giorgio1 (AUTHOR) giorgio.domenichini@univie.ac.at

    المصدر: Journal of Chemical Physics. 3/28/2024, Vol. 160 Issue 12, p1-7. 7p.

    مصطلحات موضوعية: *NUCLEAR charge, *ATOMS, *ATOMIC orbitals, *PERTURBATION theory, *ATOMIC charges


    أضف إلى المفضلة
  9. 9
    Dissertation/ Thesis
    Exotic phases of matter in low dimensional lattices: from quantum liquids to kinetic magnetism

    المؤلفون: Morera Navarro, Ivan

    المساهمون: University/Department: Universitat de Barcelona. Departament de Física Quàntica i Astrofísica

    Thesis Advisors: Juliá-Díaz, Bruno, Soto Riera, Joan

    المصدر: TDX (Tesis Doctorals en Xarxa)

    مصطلحات موضوعية: Teoria quàntica, Teoría cuántica, Quantum theory, Àtoms, Átomos, Atoms, Magnetisme, Magnetismo, Magnetism, Ciències Experimentals i Matemàtiques

    وصف الملف: application/pdf

    URL الوصول: http://hdl.handle.net/10803/688860

    View record in TDX

    أضف إلى المفضلة
  10. 10
    Academic Journal
    Kohn–Sham inversion for open-shell systems.

    المؤلفون: Erhard, Jannis, Trushin, Egor, Görling, Andreas

    المصدر: Journal of Chemical Physics; 1/21/2025, Vol. 162 Issue 3, p1-24, 24p

    مصطلحات موضوعية: DIATOMIC molecules, WAVE functions, SYMMETRY, ATOMS, ELECTRONS


    أضف إلى المفضلة
  11. 11
    Academic Journal
    Work-biased path-sampling calculations of chemical potentials: Principles and applications to uranium oxide.

    المؤلفون: Barbour, Orane, Crocombette, Jean-Paul, Beigbedder, Theo, Tranchida, Julien, Athènes, Manuel

    المصدر: Journal of Chemical Physics; 2025, Vol. 162 Issue 2, p1-13, 13p

    مصطلحات موضوعية: CHEMICAL potential, URANIUM oxides, CHEMICAL stability, HIGH temperatures, ATOMS, URANIUM


    أضف إلى المفضلة
  12. 12
    Academic Journal
    Observing quantum coherent oscillations in a three-level atom via electromagnetically induced transparency by two-dimensional spectroscopy.

    المؤلفون: Jin, Jing-Yi-Ran, Zhang, Hao-Yue, Yao, Yi-Xuan, Chen, Rong-Hang, Ai, Qing

    المصدر: Journal of Chemical Physics; 1/7/2025, Vol. 162 Issue 1, p1-9, 9p

    مصطلحات موضوعية: EXCITED states, OSCILLATIONS, SPECTROMETRY, ATOMS


    أضف إلى المفضلة
  13. 13
    Academic Journal
    The alchemical integral transform revisited.

    المؤلفون: Krug, Simon León, Anatole von Lilienfeld, O.

    المصدر: Journal of Chemical Physics; 1/7/2025, Vol. 162 Issue 1, p1-7, 7p

    مصطلحات موضوعية: INTEGRAL transforms, NUMBER systems, ENERGY density, PARAMETERIZATION, ATOMS, HARMONIC oscillators


    أضف إلى المفضلة
  14. 14
    Dissertation/ Thesis
    Development and application of new methodologies for chemical bonding analysis

    المؤلفون: Gimferrer Andrés, Martí

    المساهمون: University/Department: Universitat de Girona. Departament de Química, University/Department: Universitat de Girona. Institut de Química Computacional i Catàlisi

    Thesis Advisors: Salvador Sedano, Pedro

    المصدر: TDX (Tesis Doctorals en Xarxa)

    مصطلحات موضوعية: Enllaços químics, Enlaces químicos, Chemical bonding, Química computacional, Computational chemistry, Desenvolupament del mètode, Desarrollo del método, Method development, Anàlisi de la funció d'ona, Análisis de función de onda, Wavefunction analysis, Estats d'oxidació, Estados de oxidación, Oxidation states, Partició d'energia, Partición de energía, Energy partition, Àtoms en molècules, Átomos en moléculas, Atoms in molecules

    وصف الملف: application/pdf

    URL الوصول: http://hdl.handle.net/10803/688430

    View record in TDX

    أضف إلى المفضلة
  15. 15
    Academic Journal
    P,T-odd effects in YbCu, YbAg, and YbAu.

    المؤلفون: Polet, Johan David, Chamorro, Yuly, Pašteka, Lukáš F., Hoekstra, Steven, Tomza, Michał, Borschevsky, Anastasia, Aucar, I. Agustín

    المصدر: Journal of Chemical Physics; 12/21/2024, Vol. 161 Issue 23, p1-16, 16p

    مصطلحات موضوعية: ELECTRIC dipole moments, POLAR effects (Chemistry), ELECTRONIC structure, ATOMS, ELECTRONS


    أضف إلى المفضلة
  16. 16
    Academic Journal
    Canonical coupled cluster binding benchmark for nanoscale noncovalent complexes at the hundred-atom scale.

    المؤلفون: Lao, Ka Un

    المصدر: Journal of Chemical Physics; 12/21/2024, Vol. 161 Issue 23, p1-18, 18p

    مصطلحات موضوعية: BINDING energy, ELECTRONIC structure, MACHINE learning, ATOMS


    أضف إلى المفضلة
  17. 17
    Academic Journal
    Self-assembly properties of zinc(II) complexes with azo ligands grafted with dodecyl chains: towards supramolecular materials driven by coordination and hydrophobic effect.

    المؤلفون: Gak Simić, Kristina1 (AUTHOR), Đorević, Ivana2 (AUTHOR) ivana.djordjevic@ihtm.bg.ac.rs, Mašulović, Aleksandra1 (AUTHOR), Radovanović, Lidija1 (AUTHOR), Jeannin, Olivier3 (AUTHOR), Camerel, Franck3 (AUTHOR), Trišović, Nemanja4 (AUTHOR)

    المصدر: CrystEngComm. 12/7/2024, Vol. 26 Issue 45, p6448-6464. 17p.

    مصطلحات موضوعية: *ATOMS in molecules theory, *NATURAL orbitals, *QUANTUM chemistry, *HYDROPHOBIC interactions, *ANALYTIC geometry, *ATOMS


    أضف إلى المفضلة
  18. 18
    Academic Journal
    empi: GPU-Accelerated Matching Pursuit with Continuous Dictionaries.

    المؤلفون: Różański, Piotr T.1 prozanski@fuw.edu.pl

    المصدر: ACM Transactions on Mathematical Software. Sep2024, Vol. 50 Issue 3, p1-17. 17p.

    مصطلحات موضوعية: ENCYCLOPEDIAS & dictionaries, ATOMS, SIGNALS & signaling


    أضف إلى المفضلة
  19. 19
    Academic Journal
    Site-specific electronic structure of covalently linked bimetallic dyads from nitrogen K-edge x-ray absorption spectroscopy.

    المؤلفون: Ryland, Elizabeth S.1 (AUTHOR), Liu, Xiaolin2 (AUTHOR), Kumar, Gaurav1 (AUTHOR), Raj, Sumana L.1 (AUTHOR), Xie, Zhu-Lin3 (AUTHOR), Mengele, Alexander K.4 (AUTHOR), Fauth, Sven S.4 (AUTHOR), Siewerth, Kevin4 (AUTHOR), Dietzek-Ivanšić, Benjamin5 (AUTHOR), Rau, Sven4 (AUTHOR), Mulfort, Karen L.3 (AUTHOR), Li, Xiaosong2 (AUTHOR), Cordones, Amy A.1 (AUTHOR) acordon@slac.stanford.edu

    المصدر: Journal of Chemical Physics. 2/28/2024, Vol. 160 Issue 8, p1-11. 11p.

    مصطلحات موضوعية: *X-ray absorption, *ATOMS, *ELECTRONIC structure, *TIME-dependent density functional theory, *X-ray spectroscopy, *TRANSITION metal catalysts, *METAL bonding


    أضف إلى المفضلة
  20. 20
    Academic Journal
    Correlation consistent basis sets designed for density functional theory: Third-row atoms (Ga–Br).

    المؤلفون: Determan, John J.1 (AUTHOR) jj-determan@wiu.edu, Wilson, Angela K.2 (AUTHOR) akwilson@msu.edu

    المصدر: Journal of Chemical Physics. 2/28/2024, Vol. 160 Issue 8, p1-13. 13p.

    مصطلحات موضوعية: *DENSITY functional theory, *ATOMS, *CHEMICAL bond lengths, *NUCLEAR energy, *ANGULAR momentum (Mechanics)


    أضف إلى المفضلة
أدوات البحث: أحصل على تغذية RSS – أرسل هذا البحث بالبريد الإلكتروني – حفظ البحث – جدول التنبيهات: لا شيء