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lines changed Original file line number Diff line number Diff line change @@ -7,16 +7,17 @@ dependencies:
77- numpy
88- openmpi
99- papermill
10- - atomistics =0.2.5
10+ - atomistics =0.3.0
1111- cloudpickle =3.1.1
1212- flux-core =0.59.0
1313- gpaw =24.6.0
14+ - gpaw-data <1
1415- hatchling =1.27.0
1516- hatch-vcs =0.5.0
1617- ipython =9.0.2
17- - matplotlib =3.10.3
18+ - matplotlib =3.10.6
1819- networkx =3.4.2
1920- pygraphviz =1.14
20- - pysqa =0.3.1
21+ - pysqa =0.3.2
2122- pyzmq =27.1.0
2223- qe =7.5
Original file line number Diff line number Diff line change @@ -12,5 +12,5 @@ dependencies:
1212- mpi4py =4.0.1
1313- networkx =3.4.2
1414- pygraphviz =1.14
15- - pysqa =0.3.1
15+ - pysqa =0.3.2
1616- pyzmq =27.1.0
Original file line number Diff line number Diff line change @@ -12,5 +12,5 @@ dependencies:
1212- mpi4py =4.0.1
1313- networkx =3.4.2
1414- pygraphviz =1.14
15- - pysqa =0.3.1
15+ - pysqa =0.3.2
1616- pyzmq =27.1.0
Original file line number Diff line number Diff line change @@ -15,5 +15,5 @@ dependencies:
1515- mpi4py =4.0.1
1616- networkx =3.4.2
1717- pygraphviz =1.14
18- - pysqa =0.3.1
18+ - pysqa =0.3.2
1919- pyzmq =27.1.0
Original file line number Diff line number Diff line change @@ -52,12 +52,12 @@ graphnotebook = [
5252]
5353mpi = [" mpi4py==4.0.1" ]
5454cluster = [
55- " pysqa==0.3.1 " ,
55+ " pysqa==0.3.2 " ,
5656 " h5py==3.14.0" ,
5757]
5858all = [
5959 " mpi4py==4.0.1" ,
60- " pysqa==0.3.1 " ,
60+ " pysqa==0.3.2 " ,
6161 " h5py==3.14.0" ,
6262 " pygraphviz==1.14" ,
6363 " networkx==3.4.2" ,
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