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Issues: qmlcode/qml

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Issues list

BoB generation
#136 opened Jan 4, 2021 by TDLemonNovecento updated Dec 8, 2024
1
BoB seg faulting on MacOS
#138 opened Apr 26, 2021 by owencqueen updated Dec 8, 2024
2
Installation fails on Windows systems with the error: invalid numeric argument '/Wno-maybe-uninitialized'
#139 opened Jul 18, 2021 by RAraghavarora updated Dec 8, 2024
1
import error
#140 opened Apr 6, 2022 by hacret updated Dec 8, 2024
1
QML on Apple silicon
#141 opened Apr 15, 2022 by viniavila updated Dec 8, 2024
1
NameError: name 'Compound' is not defined
#142 opened Oct 4, 2022 by zhaohui-accept updated Dec 8, 2024
1
Unable to install.
#143 opened Apr 30, 2023 by RokeJulianLockhart updated Dec 8, 2024
1
wheel problem
#148 opened Mar 6, 2024 by zhuolian111 updated Dec 8, 2024
@charnley
2
ModuleNotFoundError: No module named 'numpy'
#149 opened Jun 6, 2024 by UnixJunkie updated Dec 8, 2024
4
handling topology only molecules [feature request]
#150 opened Jun 7, 2024 by UnixJunkie updated Jun 7, 2024
Installation broken in fresh virtual environments
#145 opened Jul 25, 2023 by EdmundGoodman updated Jun 6, 2024
3
Space in -pthread arguments fails compilation
#124 opened Feb 14, 2020 by guimaluf updated May 7, 2021
4
Anaconda deployment enhancement
#52 opened Jul 3, 2018 by larsbratholm updated Jan 13, 2021
@charnley
5
Time taken to import qml modules
#135 opened Dec 16, 2020 by puckvg updated Dec 16, 2020
@puckvg
1
Installation with Intel compiler fails
#134 opened Nov 4, 2020 by ff781 updated Nov 4, 2020
1
Problems with installation
#133 opened Aug 11, 2020 by Echo2Lee updated Aug 11, 2020
7
FHCL19 for periodic systems?
#132 opened Jul 16, 2020 by sirmarcel updated Jul 18, 2020
2
Issue when giving integer values to fchl kernel functions bug help wanted
#110 opened Mar 15, 2019 by larsbratholm updated Mar 15, 2019
FCHL example uses old notation bug help wanted
#109 opened Mar 15, 2019 by larsbratholm updated Mar 15, 2019
Documentation missing in FCHL non-critical Compiler warnings, code formatting, etc.
#87 opened Sep 11, 2018 by larsbratholm updated Sep 11, 2018
@andersx
1
Update docs to restructure enhancement
#53 opened Jul 3, 2018 by larsbratholm updated Sep 10, 2018
@larsbratholm
Change examples/tutorials to jupyter notebooks enhancement
#55 opened Jul 3, 2018 by larsbratholm updated Sep 4, 2018
@charnley
1
Look into using dask for distributed computations enhancement QOL Quality-of-Life
#80 opened Sep 4, 2018 by larsbratholm updated Sep 4, 2018
Compiler warnings non-critical Compiler warnings, code formatting, etc.
#58 opened Jul 16, 2018 by andersx updated Aug 4, 2018
@andersx
2
Include compiler and link information in help enhancement QOL Quality-of-Life
#70 opened Aug 3, 2018 by charnley updated Aug 3, 2018
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