/usr/share/abinit/psp/As-psval.psp8 is in abinit-data 8.0.8-4.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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3622 3623 3624 3625 3626 3627 3628 3629 3630 3631 3632 3633 3634 3635 3636 3637 3638 3639 3640 3641 | As ONCVPSP r_core= 1.85 1.70 2.16
33.0000 5.0000 150709 zatom,zion,pspd
8 11 2 4 600 0 pspcod,pspxc,lmax,lloc,mmax,r2well
5.99000000 0.40000000 0.00000000 rchrg fchrg qchrg
2 2 2 0 0 nproj
1 extension_switch
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4
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2 1.0000000000000D-02 -7.2288296772460D+00
3 2.0000000000000D-02 -7.2277749548801D+00
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5 4.0000000000000D-02 -7.2235597508568D+00
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8 7.0000000000000D-02 -7.2119974786722D+00
9 8.0000000000000D-02 -7.2067558321910D+00
10 9.0000000000000D-02 -7.2008255745169D+00
11 1.0000000000000D-01 -7.1942103503393D+00
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13 1.2000000000000D-01 -7.1789412360270D+00
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15 1.4000000000000D-01 -7.1609839837573D+00
16 1.5000000000000D-01 -7.1510096175592D+00
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23 2.2000000000000D-01 -7.0631247303537D+00
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560 5.5900000000000D+00 1.9650196256636D-03
561 5.6000000000000D+00 1.9353944611161D-03
562 5.6100000000000D+00 1.9062236778696D-03
563 5.6200000000000D+00 1.8775001348285D-03
564 5.6300000000000D+00 1.8492168068646D-03
565 5.6400000000000D+00 1.8213667829210D-03
566 5.6500000000000D+00 1.7939432639943D-03
567 5.6600000000000D+00 1.7669395612773D-03
568 5.6700000000000D+00 1.7403490943023D-03
569 5.6800000000000D+00 1.7141653891158D-03
570 5.6900000000000D+00 1.6883820764603D-03
571 5.7000000000000D+00 1.6629928900748D-03
572 5.7100000000000D+00 1.6379916649486D-03
573 5.7200000000000D+00 1.6133723355800D-03
574 5.7300000000000D+00 1.5891289343262D-03
575 5.7400000000000D+00 1.5652555897619D-03
576 5.7500000000000D+00 1.5417465250666D-03
577 5.7600000000000D+00 1.5185960564068D-03
578 5.7700000000000D+00 1.4957985914726D-03
579 5.7800000000000D+00 1.4733486278813D-03
580 5.7900000000000D+00 1.4512407516684D-03
581 5.8000000000000D+00 1.4294696358223D-03
582 5.8100000000000D+00 1.4080300388330D-03
583 5.8200000000000D+00 1.3869168032663D-03
584 5.8300000000000D+00 1.3661248543260D-03
585 5.8400000000000D+00 1.3456491985844D-03
586 5.8500000000000D+00 1.3254849225386D-03
587 5.8600000000000D+00 1.3056271912931D-03
588 5.8700000000000D+00 1.2860712472601D-03
589 5.8800000000000D+00 1.2668124088760D-03
590 5.8900000000000D+00 1.2478460693393D-03
591 5.9000000000000D+00 1.2291676953362D-03
592 5.9100000000000D+00 1.2107728259264D-03
593 5.9200000000000D+00 1.1926570712562D-03
594 5.9300000000000D+00 1.1748161113954D-03
595 5.9400000000000D+00 1.1572456951874D-03
596 5.9500000000000D+00 1.1399416391127D-03
597 5.9600000000000D+00 1.1228998261720D-03
598 5.9700000000000D+00 1.1061162047581D-03
599 5.9800000000000D+00 1.0895867876657D-03
600 5.9900000000000D+00 1.0733076509627D-03
# atsym z nc nv iexc psfile
As 33 6 2 4 psp8
# n l f
1 0 2.0
2 0 2.0
2 1 6.0
3 0 2.0
3 1 6.0
3 2 10.0
4 0 2.0
4 1 3.0
# lmax
2
# l rc ep ncon nbas qcut
0 1.85 0.0 4 9 5.2
1 1.7 0.0 4 7 5.5
2 2.15 0.1 4 7 4.2
# lloc lpopt rc5 dvloc0
4 5 1.6 0.0
# l nproj debl
0 2 4.5
1 2 4.5
2 2 3.0
# icmod fcfact
1 0.4
# epsh1 epsh2 depsh
-12.0 12.0 0.02
# rlmax drl
6.0 0.01
0
|