نتائج البحث - "COMPUTER software"

1

Physics-informed deep learning for solving phonon Boltzmann transport equation with large temperature non-equilibrium

المؤلفون: Ruiyang Li, Jian-Xun Wang, Eungkyu Lee, Tengfei Luo

المصدر: npj Computational Materials, Vol 8, Iss 1, Pp 1-10 (2022)

مصطلحات موضوعية: QA76.75-76.765, Mechanics of Materials, Modeling and Simulation, TA401-492, FOS: Physical sciences, General Materials Science, Computer software, Computational Physics (physics.comp-ph), Physics - Computational Physics, Materials of engineering and construction. Mechanics of materials, Computer Science Applications

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3ac2a2512004101022e88390676bba89
https://doaj.org/article/a73815644e9041c28af30734d542d597

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2

Degenerate topological line surface phonons in quasi-1D double helix crystal SnIP

المؤلفون: Bo Peng, Shuichi Murakami, Bartomeu Monserrat, Tiantian Zhang

المساهمون: Peng, B [0000-0001-6406-663X], Murakami, S [0000-0002-2033-9402], Zhang, T [0000-0002-2010-6721], Apollo - University of Cambridge Repository

المصدر: npj Computational Materials, Vol 7, Iss 1, Pp 1-8 (2021)

مصطلحات موضوعية: Surface (mathematics), Materials science, Phonon, FOS: Physical sciences, Topology, Crystal, symbols.namesake, QA76.75-76.765, Mesoscale and Nanoscale Physics (cond-mat.mes-hall), General Materials Science, Computer software, Materials of engineering and construction. Mechanics of materials, Surface states, Condensed Matter - Materials Science, Condensed Matter - Mesoscale and Nanoscale Physics, Degenerate energy levels, Materials Science (cond-mat.mtrl-sci), Computational Physics (physics.comp-ph), 5104 Condensed Matter Physics, Symmetry (physics), Computer Science Applications, Mechanics of Materials, Modeling and Simulation, Homogeneous space, symbols, TA401-492, van der Waals force, Physics - Computational Physics, 51 Physical Sciences

وصف الملف: application/pdf; text/xml

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::20b020471eff39f5aeeb7d2d882dd32d
https://doaj.org/article/67b0e4defc4041418ac0533f410c385d

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3

Towards fully automatized GW band structure calculations: What we can learn from 60.000 self-energy evaluations

المؤلفون: Asbjørn Rasmussen, Kristian Sommer Thygesen, Thorsten Deilmann

المصدر: npj Computational Materials, Vol 7, Iss 1, Pp 1-9 (2021)
npj Computational Materials
Rasmussen, A, Deilmann, T & Thygesen, K S 2021, ' Towards fully automated GW band structure calculations : What we can learn from 60.000 self-energy evaluations ', n p j Computational Materials, vol. 7, 22 . https://doi.org/10.1038/s41524-020-00480-7

مصطلحات موضوعية: Work (thermodynamics), Extrapolation, FOS: Physical sciences, 02 engineering and technology, 010402 general chemistry, 01 natural sciences, QA76.75-76.765, Operator (computer programming), General Materials Science, Computer software, Electronic band structure, Materials of engineering and construction. Mechanics of materials, Basis set, Physics, Condensed Matter - Materials Science, Materials Science (cond-mat.mtrl-sci), Computational Physics (physics.comp-ph), 021001 nanoscience & nanotechnology, 0104 chemical sciences, Computer Science Applications, Computational physics, Distribution (mathematics), Self-energy, Mechanics of Materials, Modeling and Simulation, Quasiparticle, TA401-492, 0210 nano-technology, Physics - Computational Physics

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3934e81fa40d3ef3d9c8baacf612a397
https://doaj.org/article/0c25305a31744b2f8e06dc3db031591b

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4

Identification of crystal symmetry from noisy diffraction patterns by a shape analysis and deep learning

المؤلفون: Donghun Kim, Jeongrae Kim, Sang Soo Han, Leslie Ching Ow Tiong

المصدر: npj Computational Materials, Vol 6, Iss 1, Pp 1-11 (2020)

مصطلحات موضوعية: FOS: Computer and information sciences, Diffraction, Computer Science - Machine Learning, Computer science, Crystal system, FOS: Physical sciences, 02 engineering and technology, Crystal structure, 010402 general chemistry, 01 natural sciences, Convolutional neural network, Machine Learning (cs.LG), QA76.75-76.765, General Materials Science, Computer software, Materials of engineering and construction. Mechanics of materials, business.industry, Deep learning, Space group, Pattern recognition, Computational Physics (physics.comp-ph), 021001 nanoscience & nanotechnology, 0104 chemical sciences, Computer Science Applications, Mechanics of Materials, Modeling and Simulation, TA401-492, Artificial intelligence, 0210 nano-technology, business, Physics - Computational Physics, Shape analysis (digital geometry), Monoclinic crystal system

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ab377c73e241c9b28a36b772f8ab45ca
https://doaj.org/article/0d364a8f4eba4550813da789ef5c508a

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5

Imaging atomic-scale chemistry from fused multi-modal electron microscopy

المؤلفون: Jonathan Schwartz, Zichao Wendy Di, Yi Jiang, Alyssa J. Fielitz, Don-Hyung Ha, Sanjaya D. Perera, Ismail El Baggari, Richard D. Robinson, Jeffrey A. Fessler, Colin Ophus, Steve Rozeveld, Robert Hovden

المصدر: npj Computational Materials, Vol 8, Iss 1, Pp 1-8 (2022)
npj Computational Materials, vol 8, iss 1

مصطلحات موضوعية: Condensed Matter - Materials Science, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, Computational Physics (physics.comp-ph), Computer Science Applications, QA76.75-76.765, Mechanics of Materials, Modeling and Simulation, TA401-492, Biomedical Imaging, General Materials Science, Computer software, Physics - Computational Physics, Materials of engineering and construction. Mechanics of materials

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a959b48b6502aea32e52e4664e4aecbb
https://doi.org/10.1038/s41524-021-00692-5

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6

The critical role of hot carrier cooling in optically excited structural transitions

المؤلفون: Shu-Shen Li, Lin-Wang Wang, Jun-Wei Luo, Wen-Hao Liu

المصدر: npj Computational Materials, vol 7, iss 1
npj Computational Materials, Vol 7, Iss 1, Pp 1-6 (2021)

مصطلحات موضوعية: Phase transition, Materials science, FOS: Physical sciences, 02 engineering and technology, Electron, Kinetic energy, 01 natural sciences, Molecular physics, QA76.75-76.765, 0103 physical sciences, Physics::Atomic and Molecular Clusters, General Materials Science, Computer software, Physics::Atomic Physics, 010306 general physics, Materials of engineering and construction. Mechanics of materials, Condensed Matter - Materials Science, Materials Science (cond-mat.mtrl-sci), Computational Physics (physics.comp-ph), 021001 nanoscience & nanotechnology, Antibonding molecular orbital, Computer Science Applications, Mechanics of Materials, Modeling and Simulation, Excited state, TA401-492, Density functional theory, 0210 nano-technology, Ultrashort pulse, Physics - Computational Physics, Recombination

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fe4cef1eaebd9e448f4fec36da3f8b97
https://escholarship.org/uc/item/5gb5v8gh

7

Local and correlated studies of humidity-mediated ferroelectric thin film surface charge dynamics

المؤلفون: Nazanin Bassiri-Gharb, Patrycja Paruch, Albert Verdaguer, Neus Domingo, Iaroslav Gaponenko, Nicolas Stucki, Loïc Musy

المساهمون: Swiss National Science Foundation, Ministerio de Ciencia, Innovación y Universidades (España), National Science Foundation (US), Gaponenko, Iaroslav, Musy, Loïc, Domingo, Neus, Bassiri-Gharb, Nazanin, Gaponenko, Iaroslav [0000-0002-9694-7033], Musy, Loïc [0000-0002-7741-6763], Domingo, Neus [0000-0002-5229-6638], Bassiri-Gharb, Nazanin [0000-0002-0183-5160]

المصدر: npj Computational Materials, Vol 7, Iss 1, Pp 1-7 (2021)
Digital.CSIC. Repositorio Institucional del CSIC
instname
npj computational materials, Vol. 7, No 1 (2021) P. 163

مصطلحات موضوعية: Ferroelectric thin-films, Sensing applications, Materials science, Kelvin probe microscopy, Passivation, FOS: Physical sciences, ddc:500.2, 02 engineering and technology, 01 natural sciences, QA76.75-76.765, 0103 physical sciences, General Materials Science, Surface charge, Computer software, Electrochemical phenomenon, Thin film, Materials of engineering and construction. Mechanics of materials, 010302 applied physics, Kelvin probe force microscope, Condensed Matter - Materials Science, Condensed matter physics, Applied surface, Thin film surfaces, Materials Science (cond-mat.mtrl-sci), Dictionary learning, Charge (physics), Dissipation, Computational Physics (physics.comp-ph), 021001 nanoscience & nanotechnology, Ferroelectricity, 3. Good health, Computer Science Applications, Ferroelectric polarization, Surface voltages, Mechanics of Materials, Modeling and Simulation, TA401-492, 0210 nano-technology, Charge dynamics, Physics - Computational Physics, Voltage