| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/analysis/ |
| H A D | orb.F | 25 integer ne(2),ispin,npack1,nemax local
26 common / ORB_BLOCK / sum,a,b0,lorb,ne,ispin,npack1,nemax local
130 integer ne(2),ispin,npack1,nemax local
131 common / ORB_BLOCK / sum,a,b0,lorb,ne,ispin,npack1,nemax local
172 integer ne(2),ispin,npack1,nemax local
173 common / ORB_BLOCK / sum,a,b0,lorb,ne,ispin,npack1,nemax local
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| H A D | orb_pop_aorb.F | 11 subroutine Orb_pop_aorb(flag,ispin,ne,npack1,nemax,c2, argument
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| H A D | orb_pop_kawai.F | 11 subroutine Orb_pop_kawai(flag,ispin,ne,npack1,nemax,c2, argument
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| H A D | orb_pop.F | 12 > ispin,ne,npack1,nemax,c2, argument
18 integer npack1,nemax local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/analysis/ |
| H A D | orb_pop_aorb.F | 11 subroutine Orb_pop_aorb(flag,ispin,ne,npack1,nemax,c2, argument
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| H A D | orb_pop_kawai.F | 11 subroutine Orb_pop_kawai(flag,ispin,ne,npack1,nemax,c2, argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/electron/ |
| H A D | psi_lmbda.f | 4 subroutine psi_lmbda(ispin,ne,nemax,npack1, argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/lib/electron/ |
| H A D | psi_lmbda.f | 4 subroutine psi_lmbda(ispin,ne,nemax,npack1, argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/cpsd/ |
| H A D | psi_lmbda3.f | 5 subroutine psi_lmbda3(ispin,ne,nemax,npack1, argument
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| H A D | cpmd_qmmm_step.F | 25 integer ne(2),nemax local
34 > ispin,ne,npack1,nfft3d,nemax, local
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| H A D | psi_lmbda_paw.f | 9 subroutine psi_lmbda_paw(ispin,ne,nemax,npack1, argument
14 integer ispin,ne(2),nemax,npack1 local
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| H A D | psi_lmbda2.f | 8 subroutine psi_lmbda2(ispin,ne,nemax,npack1, argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/cpsd/ |
| H A D | psi_lmbda3.f | 5 subroutine psi_lmbda3(ispin,ne,nemax,npack1, argument
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| H A D | psi_lmbda_paw.f | 9 subroutine psi_lmbda_paw(ispin,ne,nemax,npack1, argument
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| H A D | psi_lmbda2.f | 8 subroutine psi_lmbda2(ispin,ne,nemax,npack1, argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/lib/thermostats/ |
| H A D | nose-hoover.F | 11 subroutine Nose_Init(nemax,eke0) argument
13 integer nemax local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/thermostats/ |
| H A D | nose-hoover.F | 11 subroutine Nose_Init(nemax,eke0) argument
13 integer nemax local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/thermostats/ |
| H A D | nose-hoover.F | 11 subroutine Nose_Init(nemax,eke0) argument
13 integer nemax local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/lib/thermostats/ |
| H A D | nose-hoover.F | 11 subroutine Nose_Init(nemax,eke0) argument
13 integer nemax local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/lib/psi/ |
| H A D | geodesic1.F | 28 integer npack1,nemax,nelc1 local
127 integer npack1,nemax local
317 integer npack1,nemax local
454 integer npack1,nemax local
572 integer npack1,nemax local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/dplot/ |
| H A D | pspw_dplot.F | 1468 subroutine psi_translate(trans,npack1,nemax,psi) argument
1471 integer npack1,nemax local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/paw/paw_psi/ |
| H A D | paw_geodesic.F | 28 integer npack1,nemax,nelc1 local
127 integer npack1,nemax local
259 integer npack1,nemax local
397 integer npack1,nemax local
522 integer npack1,nemax local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/paw/paw_psi/ |
| H A D | paw_psi.F | 118 subroutine paw_psi_lmbda(ispin,ne,nemax,npack1, argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/lib/psi/ |
| H A D | berry_phase_pol.F | 16 integer pivs(2),smat(2),nemax,info,n,ik,j local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/dplot/ |
| H A D | pspw_dplot_iteration.F | 109 integer nfft3d,npack1,nemax,rtdb local
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