high_throughput.zip
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high_throughput
Ag2Hf2
band
band.in
24.1 kB
band.out
368.2 kB
band.pdf
27.6 kB
band.sh
412 Bytes
known_hosts
175 Bytes
out
aiida.xml
1.4 MB
ht
H_R.txt
79.3 kB
aiida.xml
2.9 MB
band.in
23.2 kB
band.out
2.5 kB
band.txt
207.0 kB
ht.sh
509 Bytes
scf.in
1.2 kB
scf.out
1.3 MB
scdm
aiida.eig
512.0 kB
aiida.win
47.2 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
12.7 kB
band.pdf
33.6 kB
known_hosts
175 Bytes
nscf.in
40.3 kB
nscf.out
10.0 kB
out
aiida.xml
2.1 MB
pw2w.in
248 Bytes
pw2w.out
11.4 kB
scdm.sh
1.7 kB
wan1.win
47.2 kB
wan1.wout
18.6 kB
wan2.win
47.2 kB
wan2.wout
9.4 MB
scdm_ht
aiida.eig
928.0 kB
aiida.win
47.1 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
12.7 kB
band.pdf
32.2 kB
ht_args
100 Bytes
known_hosts
175 Bytes
nscf.in
40.3 kB
nscf.out
10.0 kB
out
aiida.xml
2.1 MB
pw2w.in
170 Bytes
pw2w.out
11.4 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
47.1 kB
wan1.wout
18.6 kB
wan2.win
47.1 kB
wan2.wout
9.4 MB
scf
out
aiida.xml
249.6 kB
scf.in
1.2 kB
scf.out
135.3 kB
scf.sh
381 Bytes
Ag2Sc
band
band.in
22.6 kB
band.out
291.6 kB
band.sh
412 Bytes
out
aiida.xml
1.1 MB
ht
H_R.txt
329.2 kB
aiida.xml
9.7 MB
band.in
21.7 kB
band.out
2.5 kB
band.txt
149.6 kB
ht.sh
509 Bytes
scf.in
1.2 kB
scf.out
4.4 MB
scdm
aiida.eig
998.4 kB
aiida.win
91.7 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.8 kB
nscf.in
102.7 kB
nscf.out
9.3 kB
out
aiida.xml
4.2 MB
pw2w.in
248 Bytes
pw2w.out
24.4 kB
scdm.sh
1.7 kB
wan1.win
91.7 kB
wan1.wout
19.5 kB
wan2.win
91.7 kB
wan2.wout
2.4 MB
scdm_ht
aiida.eig
1.8 MB
aiida.win
91.6 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.8 kB
ht_args
100 Bytes
nscf.in
102.7 kB
nscf.out
9.3 kB
out
aiida.xml
4.2 MB
pw2w.in
170 Bytes
pw2w.out
24.4 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
91.6 kB
wan1.wout
19.5 kB
wan2.win
91.6 kB
wan2.wout
2.5 MB
scf
out
aiida.xml
696.2 kB
scf.in
1.1 kB
scf.out
354.3 kB
scf.sh
381 Bytes
Ag2Ti4
band
band.in
25.7 kB
band.out
499.8 kB
band.pdf
40.5 kB
band.sh
412 Bytes
known_hosts
175 Bytes
out
aiida.xml
2.0 MB
ht
H_R.txt
60.3 kB
aiida.xml
3.1 MB
band.in
24.6 kB
band.out
2.7 kB
band.txt
199.7 kB
ht.sh
509 Bytes
scf.in
1.3 kB
scf.out
1.3 MB
scdm
aiida.eig
557.6 kB
aiida.win
40.5 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
13.4 kB
nscf.in
29.8 kB
nscf.out
10.4 kB
out
aiida.xml
2.2 MB
pw2w.in
248 Bytes
pw2w.out
9.3 kB
scdm.sh
1.7 kB
wan1.win
40.5 kB
wan1.wout
18.7 kB
wan2.win
40.5 kB
wan2.wout
2.9 MB
scdm_ht
aiida.eig
1.0 MB
aiida.win
40.4 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
13.4 kB
ht_args
100 Bytes
nscf.in
29.8 kB
nscf.out
10.4 kB
out
aiida.xml
2.2 MB
pw2w.in
170 Bytes
pw2w.out
9.3 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
40.5 kB
wan1.wout
18.7 kB
wan2.win
40.4 kB
wan2.wout
4.5 MB
scf
out
aiida.xml
317.6 kB
scf.in
1.3 kB
scf.out
170.5 kB
scf.sh
381 Bytes
Ag2Y
band
band.in
21.7 kB
band.out
280.2 kB
band.sh
412 Bytes
out
aiida.xml
1.0 MB
ht
H_R.txt
274.4 kB
aiida.xml
8.7 MB
band.in
20.9 kB
band.out
2.6 kB
band.txt
156.3 kB
ht.sh
509 Bytes
scf.in
1.1 kB
scf.out
3.9 MB
scdm
aiida.eig
1.0 MB
aiida.win
85.3 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.4 kB
nscf.in
94.9 kB
nscf.out
9.5 kB
out
aiida.xml
4.2 MB
pw2w.in
248 Bytes
pw2w.out
22.9 kB
scdm.sh
1.7 kB
wan1.win
85.4 kB
wan1.wout
19.5 kB
wan2.win
85.3 kB
wan2.wout
8.4 MB
scdm_ht
aiida.eig
1.9 MB
aiida.win
85.3 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.4 kB
ht_args
100 Bytes
nscf.in
94.9 kB
nscf.out
9.5 kB
out
aiida.xml
4.2 MB
pw2w.in
170 Bytes
pw2w.out
22.9 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
85.3 kB
wan1.wout
19.5 kB
wan2.win
85.3 kB
wan2.wout
8.4 MB
scf
out
aiida.xml
604.9 kB
scf.in
1.1 kB
scf.out
310.9 kB
scf.sh
381 Bytes
Ag4Sc2
band
band.in
22.7 kB
band.out
485.8 kB
band.sh
412 Bytes
out
aiida.xml
2.0 MB
ht
H_R.txt
48.2 kB
aiida.xml
2.5 MB
band.in
21.6 kB
band.out
2.6 kB
band.txt
175.4 kB
ht.sh
509 Bytes
scf.in
1.3 kB
scf.out
1.1 MB
scdm
aiida.eig
497.7 kB
aiida.win
36.1 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
11.8 kB
nscf.in
26.7 kB
nscf.out
11.0 kB
out
aiida.xml
1.9 MB
pw2w.in
248 Bytes
pw2w.out
8.6 kB
scdm.sh
1.7 kB
wan1.win
36.1 kB
wan1.wout
18.7 kB
wan2.win
36.1 kB
wan2.wout
13.2 MB
scdm_ht
aiida.eig
902.0 kB
aiida.win
36.0 kB
aiida_band.gnu
1.1 kB
aiida_band.kpt
11.8 kB
ht_args
100 Bytes
nscf.in
26.7 kB
nscf.out
11.0 kB
out
aiida.xml
1.9 MB
pw2w.in
170 Bytes
pw2w.out
8.6 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
36.1 kB
wan1.wout
18.7 kB
wan2.win
36.0 kB
wan2.wout
13.2 MB
scf
out
aiida.xml
277.3 kB
scf.in
1.3 kB
scf.out
144.3 kB
scf.sh
381 Bytes
AgMg
band
band.in
22.8 kB
band.out
195.9 kB
band.sh
412 Bytes
out
aiida.xml
579.3 kB
ht
H_R.txt
147.2 kB
aiida.xml
2.8 MB
band.in
21.9 kB
band.out
2.5 kB
band.txt
84.5 kB
ht.sh
509 Bytes
scf.in
1.1 kB
scf.out
1.3 MB
scdm
aiida.eig
384.0 kB
aiida.win
74.4 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
12.0 kB
nscf.in
79.2 kB
nscf.out
8.1 kB
out
aiida.xml
1.8 MB
pw2w.in
248 Bytes
pw2w.out
19.6 kB
scdm.sh
1.7 kB
wan1.win
74.4 kB
wan1.wout
18.0 kB
wan2.win
74.4 kB
wan2.wout
4.9 MB
scdm_ht
aiida.eig
696.0 kB
aiida.win
74.3 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
12.0 kB
ht_args
100 Bytes
nscf.in
79.2 kB
nscf.out
8.1 kB
out
aiida.xml
1.8 MB
pw2w.in
170 Bytes
pw2w.out
19.6 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
74.3 kB
wan1.wout
18.0 kB
wan2.win
74.3 kB
wan2.wout
4.9 MB
scf
out
aiida.xml
130.6 kB
scf.in
1.0 kB
scf.out
85.8 kB
scf.sh
381 Bytes
AgSc
band
band.in
22.1 kB
band.out
225.4 kB
band.sh
412 Bytes
out
aiida.xml
725.5 kB
ht
H_R.txt
147.2 kB
aiida.xml
3.3 MB
band.in
21.2 kB
band.out
2.5 kB
band.txt
103.3 kB
ht.sh
509 Bytes
scf.in
1.1 kB
scf.out
1.5 MB
scdm
aiida.eig
512.0 kB
aiida.win
73.9 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
11.6 kB
nscf.in
79.2 kB
nscf.out
7.5 kB
out
aiida.xml
2.3 MB
pw2w.in
248 Bytes
pw2w.out
19.5 kB
scdm.sh
1.7 kB
wan1.win
73.9 kB
wan1.wout
18.0 kB
wan2.win
73.9 kB
wan2.wout
5.5 MB
scdm_ht
aiida.eig
928.0 kB
aiida.win
73.8 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
11.6 kB
ht_args
100 Bytes
nscf.in
79.2 kB
nscf.out
7.5 kB
out
aiida.xml
2.3 MB
pw2w.in
170 Bytes
pw2w.out
19.5 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
73.8 kB
wan1.wout
18.0 kB
wan2.win
73.8 kB
wan2.wout
5.5 MB
scf
out
aiida.xml
144.7 kB
scf.in
1.0 kB
scf.out
89.9 kB
scf.sh
381 Bytes
AgY
band
band.in
20.8 kB
band.out
214.4 kB
band.sh
412 Bytes
out
aiida.xml
685.7 kB
ht
H_R.txt
115.8 kB
aiida.xml
2.9 MB
band.in
20.0 kB
band.out
2.6 kB
band.txt
109.3 kB
ht.sh
509 Bytes
scf.in
1.1 kB
scf.out
1.3 MB
scdm
aiida.eig
443.2 kB
aiida.win
57.5 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
10.9 kB
nscf.in
58.0 kB
nscf.out
8.5 kB
out
aiida.xml
1.9 MB
pw2w.in
248 Bytes
pw2w.out
15.2 kB
scdm.sh
1.7 kB
wan1.win
57.5 kB
wan1.wout
18.0 kB
wan2.win
57.5 kB
wan2.wout
6.5 MB
scdm_ht
aiida.eig
803.4 kB
aiida.win
57.4 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
10.9 kB
ht_args
100 Bytes
nscf.in
58.0 kB
nscf.out
8.5 kB
out
aiida.xml
1.9 MB
pw2w.in
170 Bytes
pw2w.out
15.2 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
57.5 kB
wan1.wout
18.0 kB
wan2.win
57.4 kB
wan2.wout
6.5 MB
scf
out
aiida.xml
146.1 kB
scf.in
1.0 kB
scf.out
92.3 kB
scf.sh
381 Bytes
Al12Ni4
band
band.in
18.5 kB
band.out
409.8 kB
band.sh
412 Bytes
out
aiida.xml
1.7 MB
ht
H_R.txt
25.3 kB
aiida.xml
2.1 MB
band.in
16.7 kB
band.out
2.7 kB
band.txt
297.2 kB
ht.sh
509 Bytes
scf.in
2.0 kB
scf.out
867.8 kB
scdm
aiida.eig
515.2 kB
aiida.win
24.6 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
9.1 kB
nscf.in
15.7 kB
nscf.out
16.6 kB
out
aiida.xml
1.7 MB
pw2w.in
270 Bytes
pw2w.out
6.3 kB
scdm.sh
1.7 kB
wan1.win
24.6 kB
wan1.wout
20.0 kB
wan2.win
24.6 kB
wan2.wout
28.6 MB
scdm_ht
aiida.eig
933.8 kB
aiida.win
24.5 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
9.1 kB
ht_args
100 Bytes
nscf.in
15.7 kB
nscf.out
16.6 kB
out
aiida.xml
1.7 MB
pw2w.in
192 Bytes
pw2w.out
6.3 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
24.6 kB
wan1.wout
20.0 kB
wan2.win
24.5 kB
wan2.wout
28.6 MB
scf
out
aiida.xml
286.0 kB
scf.in
1.9 kB
scf.out
158.2 kB
scf.sh
381 Bytes
Al18Co4
band
band.in
16.7 kB
band.out
393.2 kB
band.sh
412 Bytes
out
aiida.xml
1.6 MB
ht
H_R.txt
16.4 kB
aiida.xml
1.6 MB
band.in
14.5 kB
band.out
2.7 kB
band.txt
328.0 kB
ht.sh
509 Bytes
scf.in
2.4 kB
scf.out
693.6 kB
scdm
aiida.eig
445.4 kB
aiida.win
20.3 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
7.9 kB
nscf.in
11.8 kB
nscf.out
14.8 kB
out
aiida.xml
1.4 MB
pw2w.in
270 Bytes
pw2w.out
5.4 kB
scdm.sh
1.7 kB
wan1.win
20.3 kB
wan1.wout
20.3 kB
wan2.win
20.3 kB
wan2.wout
36.3 MB
scdm_ht
aiida.eig
807.4 kB
aiida.win
20.2 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
7.9 kB
ht_args
100 Bytes
nscf.in
11.8 kB
nscf.out
14.8 kB
out
aiida.xml
1.4 MB
pw2w.in
192 Bytes
pw2w.out
5.4 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
20.2 kB
wan1.wout
20.3 kB
wan2.win
20.2 kB
wan2.wout
36.3 MB
scf
out
aiida.xml
286.0 kB
scf.in
2.3 kB
scf.out
164.9 kB
scf.sh
381 Bytes
Al24W6
band
band.in
16.7 kB
band.out
466.1 kB
band.sh
412 Bytes
out
aiida.xml
2.0 MB
ht
H_R.txt
16.3 kB
aiida.xml
2.2 MB
band.in
14.1 kB
band.out
2.7 kB
band.txt
436.3 kB
ht.sh
509 Bytes
scf.in
2.9 kB
scf.out
925.4 kB
scdm
aiida.eig
508.0 kB
aiida.win
19.2 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
7.6 kB
nscf.in
10.6 kB
nscf.out
348.2 kB
out
aiida.xml
1.6 MB
pw2w.in
270 Bytes
pw2w.out
5.0 kB
scdm.sh
1.7 kB
wan1.win
19.2 kB
wan1.wout
21.0 kB
wan2.win
19.2 kB
wan2.wout
49.7 MB
scdm_ht
aiida.eig
920.8 kB
aiida.win
19.1 kB
aiida_band.gnu
997 Bytes
aiida_band.kpt
7.6 kB
ht_args
100 Bytes
nscf.in
10.6 kB
nscf.out
348.2 kB
out
aiida.xml
1.6 MB
pw2w.in
192 Bytes
pw2w.out
5.0 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
19.1 kB
wan1.wout
21.0 kB
wan2.win
19.1 kB
wan2.wout
37.7 MB
scf
out
aiida.xml
402.1 kB
scf.in
2.9 kB
scf.out
214.4 kB
scf.sh
381 Bytes
Al2Mo6
band
band.in
15.8 kB
band.out
329.8 kB
band.sh
412 Bytes
out
aiida.xml
1.3 MB
ht
H_R.txt
48.8 kB
aiida.xml
2.8 MB
band.in
14.6 kB
band.out
2.6 kB
band.txt
141.4 kB
ht.sh
509 Bytes
scf.in
1.5 kB
scf.out
1.2 MB
scdm
aiida.eig
614.7 kB
aiida.win
32.0 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
7.9 kB
nscf.in
28.3 kB
nscf.out
22.6 kB
out
aiida.xml
2.3 MB
pw2w.in
248 Bytes
pw2w.out
9.0 kB
scdm.sh
1.7 kB
wan1.win
32.0 kB
wan1.wout
18.5 kB
wan2.win
32.0 kB
wan2.wout
15.8 MB
scdm_ht
aiida.eig
1.1 MB
aiida.win
31.9 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
7.9 kB
ht_args
100 Bytes
nscf.in
28.3 kB
nscf.out
22.6 kB
out
aiida.xml
2.3 MB
pw2w.in
170 Bytes
pw2w.out
9.0 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
31.9 kB
wan1.wout
18.5 kB
wan2.win
31.9 kB
wan2.wout
15.8 MB
scf
out
aiida.xml
147.6 kB
scf.in
1.4 kB
scf.out
94.7 kB
scf.sh
381 Bytes
Al2Nb6
band
band.in
15.3 kB
band.out
303.8 kB
band.sh
412 Bytes
out
aiida.xml
1.1 MB
ht
H_R.txt
48.8 kB
aiida.xml
2.8 MB
band.in
14.1 kB
band.out
2.8 kB
band.txt
136.0 kB
ht.sh
509 Bytes
scf.in
1.5 kB
scf.out
1.2 MB
scdm
aiida.eig
614.7 kB
aiida.win
31.6 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
7.6 kB
nscf.in
28.3 kB
nscf.out
23.3 kB
out
aiida.xml
2.3 MB
pw2w.in
248 Bytes
pw2w.out
9.1 kB
scdm.sh
1.7 kB
wan1.win
31.6 kB
wan1.wout
18.5 kB
wan2.win
31.6 kB
wan2.wout
2.8 MB
scdm_ht
aiida.eig
1.1 MB
aiida.win
31.5 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
7.6 kB
ht_args
100 Bytes
nscf.in
28.3 kB
nscf.out
23.3 kB
out
aiida.xml
2.3 MB
pw2w.in
170 Bytes
pw2w.out
9.1 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
31.5 kB
wan1.wout
18.5 kB
wan2.win
31.5 kB
wan2.wout
15.8 MB
scf
out
aiida.xml
141.2 kB
scf.in
1.4 kB
scf.out
90.9 kB
scf.sh
381 Bytes
Al2Os
band
band.in
25.3 kB
band.out
213.9 kB
band.sh
412 Bytes
out
aiida.xml
643.9 kB
ht
H_R.txt
459.6 kB
aiida.xml
10.6 MB
band.in
24.4 kB
band.out
2.6 kB
band.txt
123.6 kB
ht.sh
509 Bytes
scf.in
1.1 kB
scf.out
4.9 MB
scdm
aiida.eig
1.0 MB
aiida.win
116.1 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
13.3 kB
nscf.in
133.4 kB
nscf.out
43.3 kB
out
aiida.xml
4.1 MB
pw2w.in
248 Bytes
pw2w.out
30.9 kB
scdm.sh
1.7 kB
wan1.win
116.1 kB
wan1.wout
19.5 kB
wan2.win
116.1 kB
wan2.wout
7.1 MB
scdm_ht
aiida.eig
1.9 MB
aiida.win
116.0 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
13.3 kB
ht_args
100 Bytes
nscf.in
133.4 kB
nscf.out
43.3 kB
out
aiida.xml
4.1 MB
pw2w.in
170 Bytes
pw2w.out
30.9 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
116.0 kB
wan1.wout
19.5 kB
wan2.win
116.0 kB
wan2.wout
7.1 MB
scf
out
aiida.xml
564.0 kB
scf.in
1.1 kB
scf.out
320.2 kB
scf.sh
381 Bytes
Al3Nb
band
band.in
21.6 kB
band.out
182.5 kB
band.sh
412 Bytes
out
aiida.xml
551.4 kB
ht
H_R.txt
274.4 kB
aiida.xml
6.5 MB
band.in
20.6 kB
band.out
2.6 kB
band.txt
108.6 kB
ht.sh
509 Bytes
scf.in
1.2 kB
scf.out
3.0 MB
scdm
aiida.eig
622.1 kB
aiida.win
72.2 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.2 kB
nscf.in
77.1 kB
nscf.out
30.6 kB
out
aiida.xml
2.4 MB
pw2w.in
248 Bytes
pw2w.out
19.2 kB
scdm.sh
1.7 kB
wan1.win
72.3 kB
wan1.wout
19.5 kB
wan2.win
72.2 kB
wan2.wout
7.5 MB
scdm_ht
aiida.eig
1.1 MB
aiida.win
72.2 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.2 kB
ht_args
100 Bytes
nscf.in
77.1 kB
nscf.out
30.6 kB
out
aiida.xml
2.4 MB
pw2w.in
170 Bytes
pw2w.out
19.2 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
72.2 kB
wan1.wout
19.5 kB
wan2.win
72.2 kB
wan2.wout
7.5 MB
scf
out
aiida.xml
369.9 kB
scf.in
1.2 kB
scf.out
214.2 kB
scf.sh
381 Bytes
Al3Ta
band
band.in
21.5 kB
band.out
182.4 kB
band.sh
412 Bytes
out
aiida.xml
549.2 kB
ht
H_R.txt
274.4 kB
aiida.xml
7.1 MB
band.in
20.5 kB
band.out
2.6 kB
band.txt
120.7 kB
ht.sh
509 Bytes
scf.in
1.2 kB
scf.out
3.3 MB
scdm
aiida.eig
715.4 kB
aiida.win
72.2 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.2 kB
nscf.in
77.1 kB
nscf.out
32.1 kB
out
aiida.xml
2.7 MB
pw2w.in
248 Bytes
pw2w.out
19.2 kB
scdm.sh
1.7 kB
wan1.win
72.2 kB
wan1.wout
19.5 kB
wan2.win
72.2 kB
wan2.wout
5.9 MB
scdm_ht
aiida.eig
1.3 MB
aiida.win
72.1 kB
aiida_band.gnu
1.2 kB
aiida_band.kpt
11.2 kB
ht_args
100 Bytes
nscf.in
77.1 kB
nscf.out
32.1 kB
out
aiida.xml
2.7 MB
pw2w.in
170 Bytes
pw2w.out
19.2 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
72.1 kB
wan1.wout
19.5 kB
wan2.win
72.1 kB
wan2.wout
7.8 MB
scf
out
aiida.xml
369.9 kB
scf.in
1.2 kB
scf.out
214.3 kB
scf.sh
381 Bytes
Al4Mn2O8
band
band.in
12.1 kB
band.out
244.3 kB
band.sh
412 Bytes
out
aiida.xml
902.5 kB
ht
H_R.txt
48.8 kB
aiida.xml
3.0 MB
band.in
10.4 kB
band.out
2.8 kB
band.txt
79.1 kB
ht.sh
509 Bytes
scf.in
1.9 kB
scf.out
1.3 MB
scdm
aiida.eig
768.3 kB
aiida.win
29.2 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
5.6 kB
nscf.in
28.8 kB
nscf.out
21.7 kB
out
aiida.xml
2.5 MB
pw2w.in
270 Bytes
pw2w.out
9.1 kB
scdm.sh
1.7 kB
wan1.win
29.3 kB
wan1.wout
19.2 kB
wan2.win
29.2 kB
wan2.wout
22.8 MB
scdm_ht
aiida.eig
1.4 MB
aiida.win
29.2 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
5.6 kB
ht_args
100 Bytes
nscf.in
28.8 kB
nscf.out
21.4 kB
out
aiida.xml
2.5 MB
pw2w.in
192 Bytes
pw2w.out
9.1 kB
scdm_ht.sh
885 Bytes
transform.py
2.2 kB
wan1.win
29.2 kB
wan1.wout
19.2 kB
wan2.win
29.2 kB
wan2.wout
22.8 MB
scf
out
aiida.xml
150.8 kB
scf.in
1.9 kB
scf.out
100.0 kB
scf.sh
381 Bytes
Al4O8Zn2
band
band.in
12.0 kB
band.out
262.1 kB
band.sh
412 Bytes
out
aiida.xml
988.0 kB
scdm
aiida.eig
768.3 kB
aiida.win
29.2 kB
aiida_band.gnu
755 Bytes
aiida_band.kpt
5.6 kB
nscf.in
28.7 kB
nscf.out
22.4 kB
out
aiida.xml
2.5 MB
pw2w.in
248 Bytes
pw2w.out
9.1 kB
scdm.sh
1.7 kB
wan1.win
29.3 kB
wan1.wout
19.2 kB
wan2.win
29.2 kB
wan2.wout
2.1 MB
scdm_ht
aiida.win
29.2 kB
nscf.in
28.7 kB
nscf.out
22.3 kB
out
aiida.xml
2.5 MB
pw2w.in
170 Bytes
pw2w.out
9.1 kB
wan1.win
29.2 kB
wan1.wout
19.2 kB
wan2.win
29.2 kB
scf
out
aiida.xml
159.9 kB
scf.in
1.9 kB
scf.out
102.9 kB
scf.sh
381 Bytes