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p yGWBSE: a high throughput workflow package for GW-BSE calculations
Tathagata Biswas,
Arunima K. Singh
Physics
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Contribution to journal
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Article
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peer-review
6
Scopus citations
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Mathematics
Quasiparticles
94%
Work Flow
90%
High Throughput
87%
Photocatalysis
46%
First-principles Calculation
41%
Absorption Spectra
36%
Metadata
34%
Band Structure
30%
Python
30%
Density Functional Theory
30%
Open Source
28%
Automation
26%
Semiconductors
24%
Perturbation Theory
21%
Electronics
21%
Predict
19%
Entire
17%
Observation
13%
Framework
11%
Approximation
10%
Engineering & Materials Science
Energy gap
71%
Throughput
43%
Photocatalysis
33%
Density functional theory
31%
Absorption spectra
30%
Metadata
20%
Semiconductor materials
18%
Electronic equipment
17%
Automation
15%
Chemical Compounds
Quasiparticle
100%
Band Gap
47%
Many-Body Perturbation Theory
33%
Photocatalysis
19%
Semiconductor
15%
Absorption Spectrum
15%
Density Functional Theory
13%