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Fortran

xtb

Semiempirical Extended Tight-Binding Program Package

FortranEmerging

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Forks

1

Contributors

8

Last push

12mo ago

Recent commits

Latest commits.

Merge branch 'main' into main
678e692Thomas Froitzheim12mo ago
Update `deriv_atm_triple` subroutine (#1298)
dabf307foxtran13mo ago
Avoid some heavy instructions in xtb/hamiltonian (#1299)
90980d6foxtran13mo ago
Avoid meson 1.8.1 (#1300)
c769116foxtran13mo ago
Avoid spread intrinsic (#1281)
fe1c8cefoxtran13mo ago

Catch ff case (#1287)

293469dfoxtran13mo ago

Merge branch 'main' of github.com:Thomas3R/xtb into main

2fb5e10Thomas Rose13mo ago

Exclude to-self bond in 3B-bond correction list b3list

2bedd71Thomas Rose13mo ago

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