/usr/share/espresso/pseudo/O.pbe-rrkjus.UPF is in quantum-espresso-data 6.0-3.1.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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Generated using Andrea Dal Corso code (rrkj3)
Author: Andrea Dal Corso Generation date: unknown
Info: O PBE 2s2 2p4 RRKJ3 US
1 The Pseudo was generated with a Scalar-Relativistic Calculation
1.40000000000E+00 Local Potential cutoff radius
nl pn l occ Rcut Rcut US E pseu
2S 1 0 2.00 1.40000000000 1.60000000000 0.00000000000
2S 1 0 0.00 1.40000000000 1.60000000000 0.00000000000
2P 2 1 4.00 1.40000000000 1.60000000000 0.00000000000
2P 2 1 0.00 1.40000000000 1.60000000000 0.00000000000
3D 3 2 -2.00 1.40000000000 1.40000000000 0.00000000000
</PP_INFO>
<PP_HEADER>
0 Version Number
O Element
US Ultrasoft pseudopotential
F Nonlinear Core Correction
SLA PW PBE PBE PBE Exchange-Correlation functional
6.00000000000 Z valence
-31.39526325800 Total energy
0.0000000 0.0000000 Suggested cutoff for wfc and rho
2 Max angular momentum component
1269 Number of points in mesh
2 4 Number of Wavefunctions, Number of Projectors
Wavefunctions nl l occ
2S 0 2.00
2P 1 4.00
</PP_HEADER>
<PP_MESH>
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</PP_BETA>
<PP_BETA>
4 1 Beta L
865
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-3.35169824167E-01 3.07306619074E-01 8.59812985660E-01 1.30665763522E+00
1.63134308049E+00 1.81659958195E+00 1.84444773268E+00 1.69609121578E+00
1.35358844042E+00 7.84310129423E-01 9.34042353400E-02 -9.44140738031E-03
7.83490373166E-04 -2.43535300207E-04 -1.50352382887E-04 -1.68199365630E-04
-1.74554928874E-04 -1.81619329030E-04 -1.88186155070E-04 -1.94383210815E-04
-2.00206189198E-04
</PP_BETA>
<PP_DIJ>
6 Number of nonzero Dij
1 1 9.59525296517E-01
1 2 -2.64711790879E+00
2 2 4.55137672493E+00
3 3 1.25561736448E+00
3 4 1.70238011803E+00
4 4 2.30001024705E+00
</PP_DIJ>
<PP_QIJ>
0 nqf. If not zero, Qij's inside rinner are computed using qfcoef's
1 1 0 i j (l(j))
-1.02249591351E-01 Q_int
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3.31662888970E-01 3.34825176413E-01 3.38014132846E-01 3.41229875399E-01
3.44472518026E-01 3.47742171355E-01 3.51038942526E-01 3.54362935035E-01
3.57714248565E-01 3.61092978814E-01 3.64499217321E-01 3.67933051283E-01
3.71394563366E-01 3.74883831519E-01 3.78400928771E-01 3.81945923028E-01
3.85518876867E-01 3.89119847321E-01 3.92748885652E-01 3.96406037133E-01
4.00091340809E-01 4.03804829257E-01 4.07546528344E-01 4.11316456970E-01
4.15114626812E-01 4.18941042056E-01 4.22795699120E-01 4.26678586383E-01
4.30589683886E-01 4.34528963046E-01 4.38496386347E-01 4.42491907034E-01
4.46515468791E-01 4.50567005419E-01 4.54646440501E-01 4.58753687056E-01
4.62888647197E-01 4.67051211762E-01 4.71241259957E-01 4.75458658974E-01
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6.88200626789E-01 6.93226357788E-01 6.98250692959E-01 7.03272312929E-01
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7.28290672228E-01 7.33266011256E-01 7.38228245460E-01 7.43175718767E-01
7.48106730532E-01 7.53019535062E-01 7.57912341162E-01 7.62783311709E-01
7.67630563270E-01 7.72452165736E-01 7.77246142011E-01 7.82010467732E-01
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5.31438159828E-01 5.22418037948E-01 5.13403676351E-01 5.04399379248E-01
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3.24467700873E-01 3.16625827252E-01 3.08871912046E-01 3.01208211434E-01
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2.36613745264E-01 2.29952650116E-01 2.23399490004E-01 2.16955232818E-01
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1.86394103918E-01 1.80617810505E-01 1.74954332970E-01 1.69403838492E-01
1.63966401397E-01 1.58642005096E-01 1.53430544122E-01 1.48331826230E-01
1.43345574581E-01 1.38471429987E-01 1.33708953211E-01 1.29057627326E-01
1.24516860116E-01 1.20085986521E-01 1.15764271108E-01 1.11550910579E-01
1.07445036295E-01 1.03445716819E-01 9.95519604690E-02 9.57627178778E-02
9.20768845548E-02 8.84933034441E-02 8.50107674757E-02 8.16280221063E-02
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6.61642387702E-02 6.33515488901E-02 6.06287481738E-02 5.79942914207E-02
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4.60914217364E-02 4.39533053673E-02 4.18921260558E-02 3.99061960849E-02
3.79938194785E-02 3.61532940015E-02 3.43829131240E-02 3.26809679453E-02
3.10457490799E-02 2.94755485032E-02 2.79686613572E-02 2.65233877144E-02
2.51380342993E-02 2.38109161662E-02 2.25403583329E-02 2.13246973670E-02
2.01622829258E-02 1.90514792467E-02 1.79906665864E-02 1.69782426089E-02
1.60126237186E-02 1.50922463385E-02 1.42155681310E-02 1.33810691598E-02
1.25872529922E-02 1.18326477389E-02 1.11158070315E-02 1.04353109351E-02
9.78976679684E-03 9.17781002720E-03 8.59810481502E-03 8.04934477519E-03
7.53025352863E-03 7.03958521451E-03 6.57612493483E-03 6.13868913156E-03
5.72612589707E-03 5.33731521834E-03 4.97116915609E-03 4.62663195983E-03
4.30268012038E-03 3.99832236111E-03 3.71259956994E-03 3.44458467371E-03
3.19338245722E-03 2.95812932885E-03 2.73799303538E-03 2.53217232821E-03
2.33989658362E-03 2.16042537971E-03 1.99304803264E-03 1.83708309506E-03
1.69187781931E-03 1.55680758844E-03 1.43127531771E-03 1.31471082956E-03
1.20657020465E-03 1.10633511206E-03 1.01351212108E-03 9.27631997632E-04
8.48248987623E-04 7.74940090134E-04 7.07304322709E-04 6.44961981272E-04
5.87553896970E-04 5.34740692148E-04 4.86202037598E-04 4.41635913079E-04
4.00757872992E-04 3.63300319024E-04 3.29011781382E-04 2.97656210196E-04
2.69012278487E-04 2.42872698022E-04 2.19043549225E-04 1.97343626217E-04
1.77603797931E-04 1.59666386132E-04 1.43384561070E-04 1.28621755377E-04
1.15251096709E-04 1.03154859560E-04 9.22239365322E-05 8.23573293119E-05
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4.59617517988E-05 4.07550414550E-05 3.60941134264E-05 3.19268872756E-05
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1.69649566781E-05 1.48920335636E-05 1.30551975689E-05 1.14297230555E-05
9.99321949435E-06 8.72543913617E-06 7.60809765179E-06 6.62470714394E-06
5.76042093698E-06 5.00188955520E-06 4.33712730892E-06 3.75538891755E-06
3.24705561106E-06 2.80353016569E-06 2.41714034520E-06 2.08105023668E-06
1.78917898886E-06 1.53610359751E-06 1.31680922148E-06 1.12706178730E-06
9.63137612552E-07 8.21746537718E-07 6.99986147099E-07 5.95300245554E-07
5.05441262075E-07 4.28436269315E-07 3.62556326301E-07 3.06288869169E-07
2.58312892034E-07 2.17476676815E-07 1.82777847049E-07 1.53345536306E-07
1.28424476844E-07 1.07360828451E-07 8.95895811036E-08 7.46233780922E-08
6.20426185423E-08 5.14867099192E-08 4.26463520406E-08 3.52567443976E-08
2.90916182025E-08 2.39580035524E-08 1.96916504445E-08 1.61530301190E-08
1.32238503689E-08 1.08040250594E-08 8.80904417451E-09 7.16769628227E-09
5.82010040579E-09 4.71600893810E-09 3.81334746920E-09 3.07696123261E-09
2.47754135354E-09 1.99070721754E-09 1.59622410420E-09 1.27733776972E-09
1.02020994017E-09 8.13440717338E-10 6.47665725349E-10 5.15217460175E-10
4.09841769945E-10 3.25250566360E-10 2.57505105778E-10 2.03380451645E-10
1.60242490134E-10 1.25944935272E-10 9.87432910027E-11 7.72231603501E-11
6.02406618488E-11 4.68730361629E-11 3.63778065970E-11 2.81591007359E-11
2.17399510469E-11 1.67395738481E-11 1.28547821275E-11 9.84482146487E-12
7.51903260082E-12 5.72684156110E-12 4.34966092897E-12 3.29435586501E-12
2.48798756168E-12 1.87359653949E-12 1.40682989633E-12 1.05325149445E-12
7.86203137969E-13 5.85108946332E-13 4.34135133803E-13 3.21133920083E-13
2.36813887881E-13 1.74090250484E-13 1.27577605646E-13 9.31951778750E-14
6.78605817128E-14 4.92530196873E-14 3.56307658895E-14 2.56909513606E-14
1.84622032603E-14 1.32227142952E-14 9.43792956343E-15 6.71331490458E-15
4.75867960605E-15 3.36132037449E-15 2.36587628986E-15 1.65927117356E-15
1.15949877020E-15 8.07300129520E-16 5.60009786904E-16 3.87022287476E-16
2.66464792467E-16 1.82764047476E-16 1.24874045493E-16 8.49899000015E-17
5.76181419952E-17 3.89072806216E-17 2.61676626114E-17 1.75284683386E-17
1.16936574761E-17 7.76902171308E-18 5.14012751228E-18 3.38652966832E-18
2.22172842654E-18 1.45132150463E-18 9.43961214710E-19 6.11284851933E-19
3.94105950357E-19 2.52954811639E-19 1.61627039434E-19 1.02803178150E-19
6.50879579264E-20 4.10181685598E-20 2.57284207336E-20 1.60616723956E-20
9.97903369701E-21 6.17000361479E-21 3.79629937875E-21 2.32430055288E-21
1.41598740143E-21 8.58301802513E-22 5.17621410832E-22 3.10565945186E-22
1.85371267959E-22 1.10066554037E-22 6.50084518378E-23 3.81911464794E-23
2.23157079346E-23 1.29685132386E-23 7.49510065026E-24 4.30773004086E-24
2.46194841109E-24 1.39908584637E-24 7.90532925137E-25 4.44099963174E-25
2.48028407733E-25 1.37707156811E-25 7.60011606369E-26 4.16933251866E-26
2.27336486773E-26 1.23197388263E-26 6.63493663257E-27 3.55097721446E-27
1.88845853369E-27 9.97901879790E-28 5.23915357411E-28 2.73274506025E-28
1.41603283510E-28 7.28878226693E-29 3.72661920711E-29 1.89244861236E-29
9.54448638919E-30 4.78046866619E-30 2.37764815905E-30 1.17423048655E-30
5.75780441180E-31 2.80302577188E-31 1.35466658823E-31 6.49891859484E-32
3.09471747443E-32 1.46264762534E-32 6.86063699949E-33 3.19346458654E-33
1.47502463168E-33 6.75992974188E-34 3.07366640093E-34 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
0.00000000000E+00
2P 1 4.00 Wavefunction
1.84474960423E-07 1.88201601482E-07 1.92003525669E-07 1.95882253805E-07
1.99839337432E-07 2.03876359435E-07 2.07994934676E-07 2.12196710638E-07
2.16483368088E-07 2.20856621743E-07 2.25318220964E-07 2.29869950447E-07
2.34513630944E-07 2.39251119988E-07 2.44084312637E-07 2.49015142230E-07
2.54045581164E-07 2.59177641680E-07 2.64413376668E-07 2.69754880492E-07
2.75204289822E-07 2.80763784493E-07 2.86435588374E-07 2.92221970262E-07
2.98125244785E-07 3.04147773328E-07 3.10291964981E-07 3.16560277501E-07
3.22955218293E-07 3.29479345418E-07 3.36135268611E-07 3.42925650326E-07
3.49853206805E-07 3.56920709159E-07 3.64130984481E-07 3.71486916974E-07
3.78991449105E-07 3.86647582785E-07 3.94458380566E-07 4.02426966867E-07
4.10556529225E-07 4.18850319570E-07 4.27311655525E-07 4.35943921732E-07
4.44750571208E-07 4.53735126727E-07 4.62901182225E-07 4.72252404242E-07
4.81792533386E-07 4.91525385832E-07 5.01454854843E-07 5.11584912334E-07
5.21919610458E-07 5.32463083225E-07 5.43219548158E-07 5.54193307980E-07
5.65388752333E-07 5.76810359539E-07 5.88462698383E-07 6.00350429949E-07
6.12478309480E-07 6.24851188281E-07 6.37474015659E-07 6.50351840904E-07
6.63489815308E-07 6.76893194226E-07 6.90567339177E-07 7.04517719992E-07
7.18749916996E-07 7.33269623247E-07 7.48082646808E-07 7.63194913073E-07
7.78612467137E-07 7.94341476213E-07 8.10388232099E-07 8.26759153698E-07
8.43460789580E-07 8.60499820605E-07 8.77883062597E-07 8.95617469066E-07
9.13710133992E-07 9.32168294665E-07 9.50999334573E-07 9.70210786363E-07
9.89810334850E-07 1.00980582009E-06 1.03020524053E-06 1.05101675617E-06
1.07224869188E-06 1.09390954069E-06 1.11600796720E-06 1.13855281104E-06
1.16155309042E-06 1.18501800574E-06 1.20895694323E-06 1.23337947876E-06
1.25829538163E-06 1.28371461850E-06 1.30964735736E-06 1.33610397162E-06
1.36309504424E-06 1.39063137195E-06 1.41872396962E-06 1.44738407461E-06
1.47662315130E-06 1.50645289565E-06 1.53688523991E-06 1.56793235738E-06
1.59960666724E-06 1.63192083960E-06 1.66488780048E-06 1.69852073705E-06
1.73283310287E-06 1.76783862327E-06 1.80355130086E-06 1.83998542109E-06
1.87715555804E-06 1.91507658017E-06 1.95376365631E-06 1.99323226171E-06
2.03349818427E-06 2.07457753077E-06 2.11648673342E-06 2.15924255635E-06
2.20286210235E-06 2.24736281971E-06 2.29276250920E-06 2.33907933116E-06
2.38633181283E-06 2.43453885569E-06 2.48371974308E-06 2.53389414784E-06
2.58508214028E-06 2.63730419611E-06 2.69058120469E-06 2.74493447738E-06
2.80038575602E-06 2.85695722169E-06 2.91467150355E-06 2.97355168787E-06
3.03362132732E-06 3.09490445033E-06 3.15742557076E-06 3.22120969765E-06
3.28628234527E-06 3.35266954330E-06 3.42039784723E-06 3.48949434903E-06
3.55998668794E-06 3.63190306154E-06 3.70527223703E-06 3.78012356274E-06
3.85648697988E-06 3.93439303449E-06 4.01387288966E-06 4.09495833804E-06
4.17768181449E-06 4.26207640910E-06 4.34817588043E-06 4.43601466897E-06
4.52562791094E-06 4.61705145239E-06 4.71032186343E-06 4.80547645299E-06
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