From e4a0b0722500528abbb7fe67c4f0c43246ba9662 Mon Sep 17 00:00:00 2001 From: Philip Eisenlohr Date: Wed, 21 Jun 2023 11:21:44 -0400 Subject: [PATCH] removed confusing Schmid-Boas in favor of cleaner Thompson tetrahedron notation --- src/lattice.f90 | 74 ++++++++++++++++++++++++------------------------- 1 file changed, 37 insertions(+), 37 deletions(-) diff --git a/src/lattice.f90 b/src/lattice.f90 index 350860ecb..96a55aea4 100644 --- a/src/lattice.f90 +++ b/src/lattice.f90 @@ -40,19 +40,19 @@ module lattice real(pREAL), dimension(3+3,CF_NSLIP), parameter :: & CF_SYSTEMSLIP = reshape(real([& - ! <110>{111} systems - 0, 1,-1, 1, 1, 1, & ! B2 - -1, 0, 1, 1, 1, 1, & ! B4 - 1,-1, 0, 1, 1, 1, & ! B5 - 0,-1,-1, -1,-1, 1, & ! C1 - 1, 0, 1, -1,-1, 1, & ! C3 - -1, 1, 0, -1,-1, 1, & ! C5 - 0,-1, 1, 1,-1,-1, & ! A2 - -1, 0,-1, 1,-1,-1, & ! A3 - 1, 1, 0, 1,-1,-1, & ! A6 - 0, 1, 1, -1, 1,-1, & ! D1 - 1, 0,-1, -1, 1,-1, & ! D4 - -1,-1, 0, -1, 1,-1, & ! D6 + ! <110>{111} systems (Thompson tetrahedron labeling according to Fig. 3 of 10.1016/S1572-4859(05)80003-8) + 0, 1,-1, 1, 1, 1, & ! δAC + -1, 0, 1, 1, 1, 1, & ! δCB + 1,-1, 0, 1, 1, 1, & ! δBA + 0,-1,-1, -1,-1, 1, & ! γBD + 1, 0, 1, -1,-1, 1, & ! γDA + -1, 1, 0, -1,-1, 1, & ! γAB + 0,-1, 1, 1,-1,-1, & ! βCA + -1, 0,-1, 1,-1,-1, & ! βAD + 1, 1, 0, 1,-1,-1, & ! βDC + 0, 1, 1, -1, 1,-1, & ! αDB + 1, 0,-1, -1, 1,-1, & ! αBC + -1,-1, 0, -1, 1,-1, & ! αCD ! <110>{110}/non-octahedral systems 1, 1, 0, 1,-1, 0, & 1,-1, 0, 1, 1, 0, & @@ -123,31 +123,31 @@ module lattice real(pREAL), dimension(3+3,CI_NSLIP), parameter :: & CI_SYSTEMSLIP = reshape(real([& ! <111>{110} systems - 1,-1, 1, 0, 1, 1, & ! D1 - -1,-1, 1, 0, 1, 1, & ! C1 - 1, 1, 1, 0,-1, 1, & ! B2 - -1, 1, 1, 0,-1, 1, & ! A2 - -1, 1, 1, 1, 0, 1, & ! A3 - -1,-1, 1, 1, 0, 1, & ! C3 - 1, 1, 1, -1, 0, 1, & ! B4 - 1,-1, 1, -1, 0, 1, & ! D4 - -1, 1, 1, 1, 1, 0, & ! A6 - -1, 1,-1, 1, 1, 0, & ! D6 - 1, 1, 1, -1, 1, 0, & ! B5 - 1, 1,-1, -1, 1, 0, & ! C5 + 1,-1, 1, 0, 1, 1, & + -1,-1, 1, 0, 1, 1, & + 1, 1, 1, 0,-1, 1, & + -1, 1, 1, 0,-1, 1, & + -1, 1, 1, 1, 0, 1, & + -1,-1, 1, 1, 0, 1, & + 1, 1, 1, -1, 0, 1, & + 1,-1, 1, -1, 0, 1, & + -1, 1, 1, 1, 1, 0, & + -1, 1,-1, 1, 1, 0, & + 1, 1, 1, -1, 1, 0, & + 1, 1,-1, -1, 1, 0, & ! <111>{112} systems - -1, 1, 1, 2, 1, 1, & ! A-4 - 1, 1, 1, -2, 1, 1, & ! B-3 - 1, 1,-1, 2,-1, 1, & ! C-10 - 1,-1, 1, 2, 1,-1, & ! D-9 - 1,-1, 1, 1, 2, 1, & ! D-6 - 1, 1,-1, -1, 2, 1, & ! C-5 - 1, 1, 1, 1,-2, 1, & ! B-12 - -1, 1, 1, 1, 2,-1, & ! A-11 - 1, 1,-1, 1, 1, 2, & ! C-2 - 1,-1, 1, -1, 1, 2, & ! D-1 - -1, 1, 1, 1,-1, 2, & ! A-8 - 1, 1, 1, 1, 1,-2, & ! B-7 + -1, 1, 1, 2, 1, 1, & + 1, 1, 1, -2, 1, 1, & + 1, 1,-1, 2,-1, 1, & + 1,-1, 1, 2, 1,-1, & + 1,-1, 1, 1, 2, 1, & + 1, 1,-1, -1, 2, 1, & + 1, 1, 1, 1,-2, 1, & + -1, 1, 1, 1, 2,-1, & + 1, 1,-1, 1, 1, 2, & + 1,-1, 1, -1, 1, 2, & + -1, 1, 1, 1,-1, 2, & + 1, 1, 1, 1, 1,-2, & ! Slip system <111>{123} 1, 1,-1, 1, 2, 3, & 1,-1, 1, -1, 2, 3, &