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https://github.com/QuantumPackage/qp2.git
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Merge branch 'dev-stable' of github.com:QuantumPackage/qp2 into dev-stable
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commit
a1debf8102
2
external/ezfio
vendored
2
external/ezfio
vendored
@ -1 +1 @@
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Subproject commit d5805497fa0ef30e70e055cde1ecec2963303e93
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Subproject commit ed1df9f3c1f51752656ca98da5693a4119add05c
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2
external/irpf90
vendored
2
external/irpf90
vendored
@ -1 +1 @@
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Subproject commit 0007f72f677fe7d61c5e1ed461882cb239517102
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Subproject commit 33ca5e1018f3bbb5e695e6ee558f5dac0753b271
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2
external/qp2-dependencies
vendored
2
external/qp2-dependencies
vendored
@ -1 +1 @@
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Subproject commit e0d0e02e9f5ece138d1520106954a881ab0b8db2
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Subproject commit fd43778e12bb5858c4c780c34346be0f158b8cc7
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@ -25,7 +25,7 @@ except ImportError:
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"quantum_package.rc"))
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print("\n".join(["", "Error:", "source %s" % f, ""]))
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sys.exit(1)
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raise
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# Compress path
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def comp_path(path):
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@ -466,8 +466,8 @@ subroutine davidson_diag_hjj_sjj(dets_in,u_in,H_jj,s2_out,energies,dim_in,sze,N_
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double precision, allocatable :: work(:)
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! y = h
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y = h_p
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y = h
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! y = h_p
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lwork = -1
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allocate(work(1))
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call dsygv(1,'V','U',shift2,y,size(y,1), &
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