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المؤلفون: Sergio Pablo-García, Santiago Morandi, Rodrigo A. Vargas-Hernández, Kjell Jorner, Žarko Ivković, Núria López, Alán Aspuru-Guzik
المصدر: Nature Computational Science. 3:433-442
مصطلحات موضوعية: Computer Networks and Communications, Computer Science (miscellaneous), Computer Science Applications
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2دورية أكاديمية
المصدر: New Journal of Physics, Vol 23, Iss 12, p 123006 (2021)
مصطلحات موضوعية: automatic differentiation, non-equilibrium steady state, inverse design, differentiable physics, open quantum systems, Science, Physics, QC1-999
وصف الملف: electronic resource
Relation: https://doaj.org/toc/1367-2630
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المصدر: Journal of Chemical Physics, 158(10):104801. AMER INST PHYSICS
مصطلحات موضوعية: Chemical Physics (physics.chem-ph), Physics - Chemical Physics, FOS: Physical sciences, General Physics and Astronomy, Computational Physics (physics.comp-ph), Physical and Theoretical Chemistry, Physics - Computational Physics
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المؤلفون: Paul Brumer, Chern Chuang, Rodrigo A. Vargas-Hernández
مصطلحات موضوعية: Rhodopsin, Computer science, Normal Distribution, General Physics and Astronomy, FOS: Physical sciences, Multi-objective optimization, Set (abstract data type), symbols.namesake, Isomerism, Robustness (computer science), Physics - Chemical Physics, Computer Simulation, Physical and Theoretical Chemistry, Gaussian process, Chemical Physics (physics.chem-ph), Quantum Physics, Physical model, Bayesian optimization, Bayes Theorem, Observable, Computational Physics (physics.comp-ph), Photochemical Processes, Retinaldehyde, symbols, Quantum Physics (quant-ph), Physics - Computational Physics, Algorithm, Stationary state
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3939391cf801f2ba96009c481db735e4
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المؤلفون: Sergei Manzhos, Tucker Carrington, Rodrigo A. Vargas-Hernández, Aditya Kamath, Roman V. Krems
المصدر: The Journal of chemical physics. 148(24)
مصطلحات موضوعية: 010304 chemical physics, Artificial neural network, Basis (linear algebra), Neural Networks, Quantum dynamics, General Physics and Astronomy, Gaussian Process Regression, Potential Energy Surface, 010402 general chemistry, 01 natural sciences, Potential energy, 0104 chemical sciences, Schrödinger equation, symbols.namesake, Kriging, 0103 physical sciences, Potential energy surface, Physics::Atomic and Molecular Clusters, symbols, Statistical physics, Physics::Chemical Physics, Physical and Theoretical Chemistry, Gaussian process, Mathematics
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المؤلفون: Joel M. Bowman, Chen Qu, Rodrigo A. Vargas-Hernández, Qi Yu, Brian L. Van Hoozen
المصدر: Journal of chemical theory and computation. 14(7)
مصطلحات موضوعية: 010304 chemical physics, Invariant polynomial, Invariant (physics), 01 natural sciences, Potential energy, Regression, Computer Science Applications, symbols.namesake, Kriging, 0103 physical sciences, Potential energy surface, symbols, Applied mathematics, Physical and Theoretical Chemistry, 010306 general physics, Representation (mathematics), Gaussian process, Mathematics
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المؤلفون: Roman V. Krems, Rodrigo A. Vargas-Hernández
مصطلحات موضوعية: Physics, Anderson localization, Quantum particle, Quantum Physics, Rabi cycle, Binary tree, Condensed matter physics, Particle number, FOS: Physical sciences, 01 natural sciences, 010305 fluids & plasmas, symbols.namesake, Lattice (order), Quantum mechanics, 0103 physical sciences, symbols, Quantum walk, sense organs, 010306 general physics, Hamiltonian (quantum mechanics), Quantum Physics (quant-ph)
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::71877475fe59bad86b2f35d89af16dd2
http://arxiv.org/abs/1802.07952 -
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المؤلفون: Rodrigo A. Vargas-Hernández, Dong H. Zhang, Y. Guan, Roman V. Krems
المصدر: New Journal of Physics. 21:022001
مصطلحات موضوعية: Chemical Physics (physics.chem-ph), Physics, Scattering, Bayesian optimization, Ab initio, FOS: Physical sciences, General Physics and Astronomy, 7. Clean energy, 01 natural sciences, Potential energy, 010305 fluids & plasmas, Computational physics, Reaction dynamics, Physics - Chemical Physics, 0103 physical sciences, Inverse scattering problem, Configuration space, Scattering theory, Physics::Chemical Physics, 010306 general physics
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المؤلفون: Roman V. Krems, Rodrigo A. Vargas-Hernández
المصدر: Journal of Physics B: Atomic, Molecular and Optical Physics. 49:235501
مصطلحات موضوعية: Condensed Matter::Quantum Gases, Physics, Anderson localization, Optical lattice, Zeeman effect, Condensed matter physics, Condensed Matter Physics, 01 natural sciences, Atomic and Molecular Physics, and Optics, 010305 fluids & plasmas, symbols.namesake, Amplitude, Lattice (order), 0103 physical sciences, symbols, Physics::Atomic Physics, 010306 general physics