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37 Open 159 Closed
37 Open 159 Closed
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Issues list

Trial generic projections with Euphonic
#197 opened Feb 7, 2023 by rebeccafair
Acoustic phonon intensity - absolute unit validation for quartz Euphonic
#196 opened Dec 6, 2022 by rebeccafair
Euphonic: Powders - separate library Euphonic Powders
#195 opened Dec 6, 2022 by rebeccafair
Quick ASE VibData -> Euphonic ForceConstants Interface Euphonic Interfaces
#194 opened Nov 8, 2022 by rebeccafair
2 of 5 tasks
@ajjackson @rebeccafair
Generate MgO higher order force constants Anharmonicity Euphonic
#193 opened Nov 8, 2022 by rebeccafair
@ajjackson
Refinable parameters: review priority Euphonic Refinable Parameters
#191 opened Jul 19, 2022 by rebeccafair
Refinable parameters: determine user needs Euphonic Refinable Parameters
#190 opened Jul 19, 2022 by rebeccafair
2 tasks
Euphonic: X-ray Epic Euphonic X-ray
#185 opened Jul 19, 2022 by rebeccafair
1 task
Euphonic: Resolution Library Epic Euphonic Resolution
#184 opened Jul 19, 2022 by rebeccafair
2 tasks
Euphonic: Refinable Parameters Epic Euphonic Refinable Parameters
#183 opened Jul 19, 2022 by rebeccafair
3 tasks
Euphonic: Anharmonicity Anharmonicity Epic Euphonic
#182 opened Jul 19, 2022 by rebeccafair
2 of 6 tasks
Euphonic: Interfaces Epic Euphonic Interfaces
#181 opened Jul 19, 2022 by rebeccafair
1 of 6 tasks
Euphonic: Powders Epic Euphonic Powders
#180 opened Jul 19, 2022 by rebeccafair
6 of 13 tasks
2
Consider further broadening speed-up by modern image-processing techniques Euphonic Resolution
#176 opened Mar 8, 2022 by ajjackson
Instrumental broadening Euphonic Resolution
#175 opened Feb 22, 2022 by ajjackson
@ajjackson
1
Literature survey on fitting force constant models to molecular dynamics simulations Euphonic Refinable Parameters
#173 opened Jun 18, 2021 by cmarooney-stfc
@krefson
1
Abins: Refactoring - caching, data flow Euphonic Powders
#165 opened Feb 22, 2021 by ajjackson
@ajjackson
Euphonic: investigate Sobol sampling for powder-averaging Euphonic Powders
#164 opened Feb 22, 2021 by ajjackson
@ajjackson
Euphonic Calculations: Performance Optimisation: Report and recommend methods for accelerating generation of dynamical matrices Euphonic
#74 opened Feb 5, 2020 by DBJochym
@krefson @DBJochym
Euphonic Calculations: Performance Optimisation: Prototype Sternheimer extrapolation of dynamical matrices Euphonic
#73 opened Feb 5, 2020 by DBJochym Sprint 09/02/2021 to 23/02/2021
@krefson
Euphonic Calculations: Performance Optimisation: Prototype co-diagonalisation of dynamical matrices Euphonic
#72 opened Feb 5, 2020 by DBJochym
@DBJochym
Euphonic Calculations: Performance Optimisation: Prototype preconditioning of dynamical matrices Euphonic
#71 opened Feb 5, 2020 by DBJochym Sprint 09/02/2021 to 23/02/2021
@DBJochym
Euphonic Calculations: Refactor Abins/Mantid to use Euphonic Euphonic Interfacing to 3rd Party Code Powders
#68 opened Feb 5, 2020 by ajjackson
1 of 2 tasks
@ajjackson
2
Euphonic Calculations: Implement analytic powder-averaged incoherent spectra in Euphonic blocked Euphonic Interfacing to 3rd Party Code Powders
#67 opened Feb 5, 2020 by ajjackson
@ajjackson
6
Make optimisation-simulation interfaces explicit Optimisation and Resolution Tobyfit
#65 opened Jan 29, 2020 by g5t
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