mirror of https://github.com/abinit/abinit.git
3611 lines
259 KiB
Plaintext
Executable File
3611 lines
259 KiB
Plaintext
Executable File
Pb ONCVPSP r_core= 2.32 2.61 2.10
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82.0000 14.0000 170103 zatom,zion,pspd
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8 -1012 2 4 600 0 pspcod,pspxc,lmax,lloc,mmax,r2well
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5.99000000 6.00000000 0.00000000 rchrg fchrg qchrg
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2 2 2 0 0 nproj
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0 extension_switch
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452 4.5100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
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453 4.5200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
454 4.5300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
455 4.5400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
456 4.5500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
457 4.5600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
458 4.5700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
459 4.5800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
460 4.5900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
461 4.6000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
462 4.6100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
463 4.6200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
464 4.6300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
465 4.6400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
466 4.6500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
467 4.6600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
468 4.6700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
469 4.6800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
470 4.6900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
471 4.7000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
472 4.7100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
473 4.7200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
474 4.7300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
475 4.7400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
476 4.7500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
477 4.7600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
478 4.7700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
479 4.7800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
480 4.7900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
481 4.8000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
482 4.8100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
483 4.8200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
484 4.8300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
485 4.8400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
486 4.8500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
487 4.8600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
488 4.8700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
489 4.8800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
490 4.8900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
491 4.9000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
492 4.9100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
493 4.9200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
494 4.9300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
495 4.9400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
496 4.9500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
497 4.9600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
498 4.9700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
499 4.9800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
500 4.9900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
501 5.0000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
502 5.0100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
503 5.0200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
504 5.0300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
505 5.0400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
506 5.0500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
507 5.0600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
508 5.0700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
509 5.0800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
510 5.0900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
511 5.1000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
512 5.1100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
513 5.1200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
514 5.1300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
515 5.1400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
516 5.1500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
517 5.1600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
518 5.1700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
519 5.1800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
520 5.1900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
521 5.2000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
522 5.2100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
523 5.2200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
524 5.2300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
525 5.2400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
526 5.2500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
527 5.2600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
528 5.2700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
529 5.2800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
530 5.2900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
531 5.3000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
532 5.3100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
533 5.3200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
534 5.3300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
535 5.3400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
536 5.3500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
537 5.3600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
538 5.3700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
539 5.3800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
540 5.3900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
541 5.4000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
542 5.4100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
543 5.4200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
544 5.4300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
545 5.4400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
546 5.4500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
547 5.4600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
548 5.4700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
549 5.4800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
550 5.4900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
551 5.5000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
552 5.5100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
553 5.5200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
554 5.5300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
555 5.5400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
556 5.5500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
557 5.5600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
558 5.5700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
559 5.5800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
560 5.5900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
561 5.6000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
562 5.6100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
563 5.6200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
564 5.6300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
565 5.6400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
566 5.6500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
567 5.6600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
568 5.6700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
569 5.6800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
570 5.6900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
571 5.7000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
572 5.7100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
573 5.7200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
574 5.7300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
575 5.7400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
576 5.7500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
577 5.7600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
578 5.7700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
579 5.7800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
580 5.7900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
581 5.8000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
582 5.8100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
583 5.8200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
584 5.8300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
585 5.8400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
586 5.8500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
587 5.8600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
588 5.8700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
589 5.8800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
590 5.8900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
591 5.9000000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
592 5.9100000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
593 5.9200000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
594 5.9300000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
595 5.9400000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
596 5.9500000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
597 5.9600000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
598 5.9700000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
599 5.9800000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
600 5.9900000000000D+00 0.0000000000000D+00 0.0000000000000D+00
|
|
4
|
|
1 0.0000000000000D+00 -1.3524412764743D+01
|
|
2 1.0000000000000D-02 -1.3524302151357D+01
|
|
3 2.0000000000000D-02 -1.3523970182509D+01
|
|
4 3.0000000000000D-02 -1.3523416488558D+01
|
|
5 4.0000000000000D-02 -1.3522640450908D+01
|
|
6 5.0000000000000D-02 -1.3521641200839D+01
|
|
7 6.0000000000000D-02 -1.3520417617396D+01
|
|
8 7.0000000000000D-02 -1.3518968324553D+01
|
|
9 8.0000000000000D-02 -1.3517291687836D+01
|
|
10 9.0000000000000D-02 -1.3515385810508D+01
|
|
11 1.0000000000000D-01 -1.3513248529387D+01
|
|
12 1.1000000000000D-01 -1.3510877410403D+01
|
|
13 1.2000000000000D-01 -1.3508269743988D+01
|
|
14 1.3000000000000D-01 -1.3505422540414D+01
|
|
15 1.4000000000000D-01 -1.3502332525186D+01
|
|
16 1.5000000000000D-01 -1.3498996134616D+01
|
|
17 1.6000000000000D-01 -1.3495409511703D+01
|
|
18 1.7000000000000D-01 -1.3491568502428D+01
|
|
19 1.8000000000000D-01 -1.3487468652608D+01
|
|
20 1.9000000000000D-01 -1.3483105205416D+01
|
|
21 2.0000000000000D-01 -1.3478473099689D+01
|
|
22 2.1000000000000D-01 -1.3473566969136D+01
|
|
23 2.2000000000000D-01 -1.3468381142561D+01
|
|
24 2.3000000000000D-01 -1.3462909645184D+01
|
|
25 2.4000000000000D-01 -1.3457146201159D+01
|
|
26 2.5000000000000D-01 -1.3451084237368D+01
|
|
27 2.6000000000000D-01 -1.3444716888553D+01
|
|
28 2.7000000000000D-01 -1.3438037003832D+01
|
|
29 2.8000000000000D-01 -1.3431037154663D+01
|
|
30 2.9000000000000D-01 -1.3423709644252D+01
|
|
31 3.0000000000000D-01 -1.3416046518440D+01
|
|
32 3.1000000000000D-01 -1.3408039578056D+01
|
|
33 3.2000000000000D-01 -1.3399680392716D+01
|
|
34 3.3000000000000D-01 -1.3390960316044D+01
|
|
35 3.4000000000000D-01 -1.3381870502275D+01
|
|
36 3.5000000000000D-01 -1.3372401924159D+01
|
|
37 3.6000000000000D-01 -1.3362545392131D+01
|
|
38 3.7000000000000D-01 -1.3352291574633D+01
|
|
39 3.8000000000000D-01 -1.3341631019524D+01
|
|
40 3.9000000000000D-01 -1.3330554176465D+01
|
|
41 4.0000000000000D-01 -1.3319051420182D+01
|
|
42 4.1000000000000D-01 -1.3307113074489D+01
|
|
43 4.2000000000000D-01 -1.3294729436962D+01
|
|
44 4.3000000000000D-01 -1.3281890804154D+01
|
|
45 4.4000000000000D-01 -1.3268587497212D+01
|
|
46 4.5000000000000D-01 -1.3254809887808D+01
|
|
47 4.6000000000000D-01 -1.3240548424242D+01
|
|
48 4.7000000000000D-01 -1.3225793657623D+01
|
|
49 4.8000000000000D-01 -1.3210536268010D+01
|
|
50 4.9000000000000D-01 -1.3194767090414D+01
|
|
51 5.0000000000000D-01 -1.3178477140557D+01
|
|
52 5.1000000000000D-01 -1.3161657640305D+01
|
|
53 5.2000000000000D-01 -1.3144300042679D+01
|
|
54 5.3000000000000D-01 -1.3126396056373D+01
|
|
55 5.4000000000000D-01 -1.3107937669698D+01
|
|
56 5.5000000000000D-01 -1.3088917173893D+01
|
|
57 5.6000000000000D-01 -1.3069327185736D+01
|
|
58 5.7000000000000D-01 -1.3049160669401D+01
|
|
59 5.8000000000000D-01 -1.3028410957517D+01
|
|
60 5.9000000000000D-01 -1.3007071771373D+01
|
|
61 6.0000000000000D-01 -1.2985137240236D+01
|
|
62 6.1000000000000D-01 -1.2962601919740D+01
|
|
63 6.2000000000000D-01 -1.2939460809312D+01
|
|
64 6.3000000000000D-01 -1.2915709368605D+01
|
|
65 6.4000000000000D-01 -1.2891343532895D+01
|
|
66 6.5000000000000D-01 -1.2866359727435D+01
|
|
67 6.6000000000000D-01 -1.2840754880713D+01
|
|
68 6.7000000000000D-01 -1.2814526436601D+01
|
|
69 6.8000000000000D-01 -1.2787672365374D+01
|
|
70 6.9000000000000D-01 -1.2760191173550D+01
|
|
71 7.0000000000000D-01 -1.2732081912551D+01
|
|
72 7.1000000000000D-01 -1.2703344186149D+01
|
|
73 7.2000000000000D-01 -1.2673978156674D+01
|
|
74 7.3000000000000D-01 -1.2643984549961D+01
|
|
75 7.4000000000000D-01 -1.2613364659028D+01
|
|
76 7.5000000000000D-01 -1.2582120346447D+01
|
|
77 7.6000000000000D-01 -1.2550254045412D+01
|
|
78 7.7000000000000D-01 -1.2517768759484D+01
|
|
79 7.8000000000000D-01 -1.2484668060998D+01
|
|
80 7.9000000000000D-01 -1.2450956088136D+01
|
|
81 8.0000000000000D-01 -1.2416637540664D+01
|
|
82 8.1000000000000D-01 -1.2381717674333D+01
|
|
83 8.2000000000000D-01 -1.2346202293949D+01
|
|
84 8.3000000000000D-01 -1.2310097745143D+01
|
|
85 8.4000000000000D-01 -1.2273410904831D+01
|
|
86 8.5000000000000D-01 -1.2236149170420D+01
|
|
87 8.6000000000000D-01 -1.2198320447768D+01
|
|
88 8.7000000000000D-01 -1.2159933137941D+01
|
|
89 8.8000000000000D-01 -1.2120996122813D+01
|
|
90 8.9000000000000D-01 -1.2081518749547D+01
|
|
91 9.0000000000000D-01 -1.2041510814018D+01
|
|
92 9.1000000000000D-01 -1.2000982543229D+01
|
|
93 9.2000000000000D-01 -1.1959944576785D+01
|
|
94 9.3000000000000D-01 -1.1918407947492D+01
|
|
95 9.4000000000000D-01 -1.1876384061149D+01
|
|
96 9.5000000000000D-01 -1.1833884675616D+01
|
|
97 9.6000000000000D-01 -1.1790921879222D+01
|
|
98 9.7000000000000D-01 -1.1747508068606D+01
|
|
99 9.8000000000000D-01 -1.1703655926068D+01
|
|
100 9.9000000000000D-01 -1.1659378396513D+01
|
|
101 1.0000000000000D+00 -1.1614688664082D+01
|
|
102 1.0100000000000D+00 -1.1569600128544D+01
|
|
103 1.0200000000000D+00 -1.1524126381548D+01
|
|
104 1.0300000000000D+00 -1.1478281182810D+01
|
|
105 1.0400000000000D+00 -1.1432078436334D+01
|
|
106 1.0500000000000D+00 -1.1385532166733D+01
|
|
107 1.0600000000000D+00 -1.1338656495751D+01
|
|
108 1.0700000000000D+00 -1.1291465619052D+01
|
|
109 1.0800000000000D+00 -1.1243973783361D+01
|
|
110 1.0900000000000D+00 -1.1196195264028D+01
|
|
111 1.1000000000000D+00 -1.1148144343089D+01
|
|
112 1.1100000000000D+00 -1.1099835287883D+01
|
|
113 1.1200000000000D+00 -1.1051282330306D+01
|
|
114 1.1300000000000D+00 -1.1002499646740D+01
|
|
115 1.1400000000000D+00 -1.0953501338726D+01
|
|
116 1.1500000000000D+00 -1.0904301414427D+01
|
|
117 1.1600000000000D+00 -1.0854913770929D+01
|
|
118 1.1700000000000D+00 -1.0805352177417D+01
|
|
119 1.1800000000000D+00 -1.0755630259267D+01
|
|
120 1.1900000000000D+00 -1.0705761483079D+01
|
|
121 1.2000000000000D+00 -1.0655759142690D+01
|
|
122 1.2100000000000D+00 -1.0605636346177D+01
|
|
123 1.2200000000000D+00 -1.0555406003866D+01
|
|
124 1.2300000000000D+00 -1.0505080817381D+01
|
|
125 1.2400000000000D+00 -1.0454673269714D+01
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