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1
المؤلفون: Yuhong Liu, Anthony D. Dutoi
المصدر: Molecular Physics. 117:446-461
مصطلحات موضوعية: Physics, 010304 chemical physics, Electronic correlation, Degrees of freedom, Biophysics, 010402 general chemistry, Condensed Matter Physics, 01 natural sciences, 0104 chemical sciences, Coupled cluster, Quantum mechanics, 0103 physical sciences, Physical and Theoretical Chemistry, Nuclear Experiment, Molecular Biology
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2
المؤلفون: Chadi Kari, Cody J. Balos, Vivek K. Pallipuram, Anthony D. Dutoi, Zachariah Abuelhaj, Syeduzzaman Khan, David Samuel, David Mueller
المصدر: Concurrency and Computation: Practice and Experience. 32
مصطلحات موضوعية: Computer Networks and Communications, Computer science, business.industry, Cloud computing, Data science, Computer Science Applications, Theoretical Computer Science, Random forest, Capacity planning, Resource (project management), Computational Theory and Mathematics, business, Software, Selection (genetic algorithm)
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3
المؤلفون: Orlando Cortazar-Martínez, Servando Aguirre-Tostado, Alejandro Torres-Ochoa, D. Cabrera-German, Dennis Nordlund, Anthony D. Dutoi, Lizeth Gomez-Muñoz, Alberto Herrera-Gomez, Milton Vázquez-Lepe, Piero Pianetta, O. Ceballos-Sanchez
المصدر: Surface and Interface Analysis. 50:246-252
مصطلحات موضوعية: Photon, Materials science, 02 engineering and technology, Surfaces and Interfaces, General Chemistry, Edge (geometry), 021001 nanoscience & nanotechnology, Condensed Matter Physics, 01 natural sciences, Spectral line, Surfaces, Coatings and Films, 0103 physical sciences, Materials Chemistry, Atomic physics, 010306 general physics, 0210 nano-technology, Intensity modulation
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4Simulation of X-ray transient absorption for following vibrations in coherently ionized F2 molecules
المؤلفون: Anthony D. Dutoi, Stephen R. Leone
المصدر: Chemical Physics. 482:249-264
مصطلحات موضوعية: 010304 chemical physics, Absorption spectroscopy, Chemistry, Wave packet, Overtone, Attosecond, Ab initio, General Physics and Astronomy, 01 natural sciences, Ionization, 0103 physical sciences, Physics::Atomic and Molecular Clusters, Physics::Chemical Physics, Physical and Theoretical Chemistry, Atomic physics, 010306 general physics, Absorption (electromagnetic radiation), Excitation
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5
المؤلفون: Liu Y, Anthony D. Dutoi
مصطلحات موضوعية: Physics, symbols.namesake, Coupled cluster, Quantum mechanics, symbols, Hamiltonian (quantum mechanics)
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::c9edb021910ffd5f57651f47daaf5e0d
https://doi.org/10.26434/chemrxiv.5330794.v2 -
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المؤلفون: Anthony D. Dutoi, Liu Y
مصطلحات موضوعية: Physics, symbols.namesake, Coupled cluster, Path (graph theory), symbols, Degrees of freedom (statistics), Structure (category theory), Charge (physics), Electronic structure, Statistical physics, Hamiltonian (quantum mechanics), Harmonic oscillator
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::21d17254115f7f494ab92ecd69399bdb
https://doi.org/10.26434/chemrxiv.5330773.v1 -
7
المؤلفون: Yuhong Liu, Anthony D. Dutoi
مصطلحات موضوعية: Physics, Chemical Physics (physics.chem-ph), Quantum Physics, 010304 chemical physics, Electronic correlation, Exciton, Biophysics, FOS: Physical sciences, Electronic structure, 010402 general chemistry, Condensed Matter Physics, 01 natural sciences, 0104 chemical sciences, symbols.namesake, Quantum mechanics, Physics - Chemical Physics, 0103 physical sciences, symbols, Physics - Atomic and Molecular Clusters, Physical and Theoretical Chemistry, Hamiltonian (quantum mechanics), Atomic and Molecular Clusters (physics.atm-clus), Quantum Physics (quant-ph), Molecular Biology, Electronic systems
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::813d0133b698f7c1fc8ba594bd7c7874
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8
المؤلفون: Anthony D. Dutoi
المصدر: Molecular Physics. 112:1-11
مصطلحات موضوعية: Current (mathematics), Computer science, Biophysics, Phase (waves), Observable, Condensed Matter Physics, Interpretation (model theory), Visualization, Classical mechanics, Atomic orbital, Simple (abstract algebra), Physical and Theoretical Chemistry, Wave function, Molecular Biology
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9
المؤلفون: Anthony D. Dutoi, Lorenz S. Cederbaum
المصدر: The Journal of Physical Chemistry Letters. 2:2300-2303
مصطلحات موضوعية: Density matrix, Electronic correlation, Ab initio quantum chemistry methods, Charge separation, Chemistry, Excited state, General Materials Science, Charge (physics), Time domain, Physical and Theoretical Chemistry, Atomic physics, Excitation
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10
المصدر: Zeitschrift für Physikalische Chemie. 224:311-324
مصطلحات موضوعية: Range (particle radiation), Transfer (group theory), Chemistry, Orbital-free density functional theory, Excited state, Quantum electrodynamics, Charge (physics), Time-dependent density functional theory, Physical and Theoretical Chemistry, Hybrid functional
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::1cc4c45c491bbf47606ede9880a56a05
https://doi.org/10.1524/zpch.2010.6107