Results 11 to 20 of about 1,211,974 (260)
Counterfactual Causality from First Principles? [PDF]
Electronic Proceedings in Theoretical Computer Science, 2017 In this position paper we discuss three main shortcomings of existing approaches to counterfactual causality from the computer science perspective, and sketch lines of work to try and overcome these issues: (1) causality definitions should be driven by a
Gregor Gössler +2 more
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Time-Dependent Magnons from First Principles [PDF]
, 2020 We propose an efficient and non-perturbative scheme to compute magnetic excitations for extended systems employing the framework of time-dependent density functional theory.
Eich, F., Rubio, A., Tancogne-Dejean, N.
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First Principles Study on Li-doped and Li,O-codoped AlN
Medžiagotyra, 2019 This paper focuses on the detailed investigation of the structural and electronic properties of wurtzite AlN crystals doped by Li with and without oxygen with the first principles calculation.
Honglei WU +5 more
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Results in Physics, 2022 In this study, we investigated the structural, elastic, electronic, and thermodynamic properties of NbCoSn and VRhSn HH compounds using the first-principles calculations as implemented in the density functional theory (DFT).
Job W. Wafula +2 more
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A First-Principles Study of Zinc Oxide Honeycomb Structures [PDF]
, 2009 We present a first-principles study of the atomic, electronic, and magnetic properties of two-dimensional (2D), single and bilayer ZnO in honeycomb structure and its armchair and zigzag nanoribbons.
E. Bekaroglu +6 more
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Electronic and geometric stability of double titanium-doped silicon clusters
Materials Research Express, 2020 We performed the genetic algorithm (GA) incorporated with density functional theory (DFT) calculations to investigate the atomic and electronic properties of a series of Ti _2 Si _n (n = 3 = –24) clusters.
Bingwen Zhang +3 more
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Frontiers in Electronic Materials, 2022 High-performance thermoelectric (TE) materials rely on semiconductors with suitable intrinsic properties for which carrier concentrations can be controlled and optimized.
Ferdaushi Alam Bipasha +4 more
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Quantum Field Theory from First Principles [PDF]
, 2000 When quantum fields are studied on manifolds with boundary, the corresponding one-loop quantum theory for bosonic gauge fields with linear covariant gauges needs the assignment of suitable boundary conditions for elliptic differential operators of ...
Esposito, Giampiero
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Spin and Statistics and First Principles [PDF]
, 2009 It was shown in the early Seventies that, in Local Quantum Theory (that is the most general formulation of Quantum Field Theory, if we leave out only the unknown scenario of Quantum Gravity) the notion of Statistics can be grounded solely on the local ...
AL Moncayo +24 more
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Lattice thermal conductivity of β-, α- and κ- Ga2O3: a first-principles computational study
Applied Physics Express, 2023 The thermal transport properties of Ga _2 O _3 in different phases remain inadequately explored. We employ first-principles calculations and the phonon Boltzmann equation to systematically study the lattice thermal conductivity of β -, α - and κ -Ga _2 O
Jinfeng Yang +5 more
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