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Remove MAP_CONSISTENT from all regtests

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oschuett committed Feb 13, 2020
1 parent 5e79acd commit ae38e45b3bce1f1ffffa51b2844dbc9b88cd9aaf
Showing with 0 additions and 269 deletions.
  1. +0 −1 tests/QMMM/QS/regtest-4/acn-conn-1.inp
  2. +0 −1 tests/QMMM/QS/regtest-4/acn-qmmm-re.inp
  3. +0 −1 tests/QMMM/QS/regtest-cdft/becke_qs.inc
  4. +0 −1 tests/QMMM/QS/regtest-cdft/dft-common-params.inc
  5. +0 −1 tests/QMMM/SE/regtest_2/Si_tersoff_qmmm.inp
  6. +0 −1 tests/QS/regtest-admm-1/H2O-admm-emd.inp
  7. +0 −1 tests/QS/regtest-all-electron/H2O-rhotot-cube.inp
  8. +0 −1 tests/QS/regtest-all-electron/H2O-xrd.inp
  9. +0 −1 tests/QS/regtest-all-electron/NO2-rhotot-cube.inp
  10. +0 −1 tests/QS/regtest-bs/cu2cl6_m1_clp6cud9.inp
  11. +0 −1 tests/QS/regtest-bs/cu2cl6_m1_std.inp
  12. +0 −1 tests/QS/regtest-bs/cu2cl6_m3_clp6cud9.inp
  13. +0 −1 tests/QS/regtest-bs/cu2cl6_m3_std.inp
  14. +0 −1 tests/QS/regtest-cdft-1/becke_qs.inc
  15. +0 −1 tests/QS/regtest-cdft-1/becke_qs_gapw.inc
  16. +0 −1 tests/QS/regtest-cdft-1/dft-common-params-gapw.inc
  17. +0 −1 tests/QS/regtest-cdft-1/dft-common-params.inc
  18. +0 −1 tests/QS/regtest-cdft-2/becke_qs.inc
  19. +0 −1 tests/QS/regtest-cdft-2/becke_qs_twoconstraints.inc
  20. +0 −1 tests/QS/regtest-cdft-2/dft-common-params-twoconstraints.inc
  21. +0 −1 tests/QS/regtest-cdft-2/dft-common-params.inc
  22. +0 −1 tests/QS/regtest-cdft-3-1/becke_qs.inc
  23. +0 −1 tests/QS/regtest-cdft-3-1/becke_qs_reversed.inc
  24. +0 −1 tests/QS/regtest-cdft-3-1/dft-common-params.inc
  25. +0 −1 tests/QS/regtest-cdft-3/becke_qs.inc
  26. +0 −1 tests/QS/regtest-cdft-3/dft-common-params.inc
  27. +0 −1 tests/QS/regtest-cdft-4-1/becke_qs.inc
  28. +0 −1 tests/QS/regtest-cdft-4-1/dft-common-params.inc
  29. +0 −1 tests/QS/regtest-cdft-4-2/becke_qs.inc
  30. +0 −1 tests/QS/regtest-cdft-4-2/dft-common-params.inc
  31. +0 −1 tests/QS/regtest-cdft-4-3/becke_qs.inc
  32. +0 −1 tests/QS/regtest-cdft-4-3/dft-common-params.inc
  33. +0 −1 tests/QS/regtest-cdft-5/becke_qs.inc
  34. +0 −1 tests/QS/regtest-cdft-5/dft-common-params.inc
  35. +0 −1 tests/QS/regtest-cdft-diag/becke_qs.inc
  36. +0 −1 tests/QS/regtest-cdft-diag/becke_qs_twocons.inc
  37. +0 −1 tests/QS/regtest-cdft-diag/becke_qs_twocons_twojacobi.inc
  38. +0 −1 tests/QS/regtest-cdft-diag/dft-common-params-alphabeta-twojacobi.inc
  39. +0 −1 tests/QS/regtest-cdft-diag/dft-common-params-alphabeta.inc
  40. +0 −1 tests/QS/regtest-cdft-diag/dft-common-params.inc
  41. +0 −1 tests/QS/regtest-cdft-hirshfeld-2/dft-common-params.inc
  42. +0 −1 tests/QS/regtest-cdft-hirshfeld-2/hirshfeld_qs.inc
  43. +0 −1 tests/QS/regtest-cdft-hirshfeld/dft-common-params.inc
  44. +0 −1 tests/QS/regtest-cdft-hirshfeld/hirshfeld_qs.inc
  45. +0 −1 tests/QS/regtest-elpa-qr/si128-elpa-qr-unsafe.inp
  46. +0 −1 tests/QS/regtest-elpa-qr/si128-elpa-qr.inp
  47. +0 −1 tests/QS/regtest-elpa-qr/si128-elpa.inp
  48. +0 −1 tests/QS/regtest-gapw-1/c8_broy_gapw_all.inp
  49. +0 −1 tests/QS/regtest-gapw-1/c8_broy_gapw_all_xashh.inp
  50. +0 −1 tests/QS/regtest-gapw-1/c8_pmix_gapw_all.inp
  51. +0 −1 tests/QS/regtest-gapw-1/c8_pmix_gapw_all_xashh.inp
  52. +0 −1 tests/QS/regtest-gapw-2/C-levelshift.inp
  53. +0 −1 tests/QS/regtest-gapw-2/Li-ROKS.inp
  54. +0 −1 tests/QS/regtest-gapw-2/NO2-ROKS.inp
  55. +0 −1 tests/QS/regtest-gpw-1/h2o_dip_berry.inp
  56. +0 −1 tests/QS/regtest-gpw-1/h2o_dip_iso.inp
  57. +0 −1 tests/QS/regtest-gpw-2-3/Au12_rmsd_AB_mtd.inp
  58. +0 −1 tests/QS/regtest-gpw-2-3/Au12_rmsd_A_mtd.inp
  59. +0 −1 tests/QS/regtest-gpw-2-3/Au13ico_mtd.inp
  60. +0 −1 tests/QS/regtest-gpw-3/CH3OH.inp
  61. +0 −1 tests/QS/regtest-gpw-4/2H2O_meta_welltemp.inp
  62. +0 −1 tests/QS/regtest-gpw-4/He3_multi_ddapc.inp
  63. +0 −1 tests/QS/regtest-gpw-4/ND3_meta_welltemp.inp
  64. +0 −1 tests/QS/regtest-gpw-4/spin_restraint.inp
  65. +0 −1 tests/QS/regtest-gpw-5/si7c_broy_gapw.inp
  66. +0 −1 tests/QS/regtest-gpw-5/si7c_broy_gapw_a04_atomic.inp
  67. +0 −1 tests/QS/regtest-gpw-5/si7c_broy_gapw_a04_nopmix.inp
  68. +0 −1 tests/QS/regtest-gpw-5/si7c_broy_gapw_a04_restart.inp
  69. +0 −1 tests/QS/regtest-gpw-5/si7c_kerker_test4.inp
  70. +0 −1 tests/QS/regtest-gpw-5/si7c_kerker_test4_nopmix.inp
  71. +0 −1 tests/QS/regtest-gpw-5/si7c_pulay_gapw.inp
  72. +0 −1 tests/QS/regtest-gpw-5/si8_broy.inp
  73. +0 −1 tests/QS/regtest-gpw-5/si8_kerker.inp
  74. +0 −1 tests/QS/regtest-gpw-5/si8_pmix.inp
  75. +0 −1 tests/QS/regtest-gpw-5/si8_pmix_nosmear_mocubes.inp
  76. +0 −1 tests/QS/regtest-gpw-5/si8_pulay.inp
  77. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_inv_dbcsr.inp
  78. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_inverse.inp
  79. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_md.inp
  80. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_mocubes.inp
  81. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_off.inp
  82. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_reduce.inp
  83. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_restore.inp
  84. +0 −1 tests/QS/regtest-gpw-5/si8_pulay_skip.inp
  85. +0 −1 tests/QS/regtest-gpw-6-2/si8_lsd_broy_stm.inp
  86. +0 −1 tests/QS/regtest-gpw-6-2/si8_lsd_broy_wc.inp
  87. +0 −1 tests/QS/regtest-gpw-6-2/si8_lsd_broy_wc_ene.inp
  88. +0 −1 tests/QS/regtest-gpw-6-2/si8_noort_broy_wc_direct_ene.inp
  89. +0 −1 tests/QS/regtest-gpw-6-2/si8_noort_broy_wc_jacobi_all.inp
  90. +0 −1 tests/QS/regtest-gpw-6-2/si8_noort_broy_wc_jacobi_ene1.inp
  91. +0 −1 tests/QS/regtest-gpw-6-2/si8_noort_broy_wc_jacobi_ene2.inp
  92. +0 −1 tests/QS/regtest-gpw-6-3/c8_kerker.inp
  93. +0 −1 tests/QS/regtest-gpw-6-3/c8_pmix.inp
  94. +0 −1 tests/QS/regtest-gpw-6-3/c8_pmix_gapw.inp
  95. +0 −1 tests/QS/regtest-gpw-6-3/si8_lsd_broy_fm0.2.inp
  96. +0 −1 tests/QS/regtest-gpw-6-3/si8_lsd_broy_wc_list.inp
  97. +0 −1 tests/QS/regtest-gpw-6-3/si8_lsd_broy_wc_list_rst.inp
  98. +0 −1 tests/QS/regtest-gpw-6-3/si8_lsd_broy_wc_rst.inp
  99. +0 −1 tests/QS/regtest-gpw-6-4/c8_broy.inp
  100. +0 −1 tests/QS/regtest-gpw-6-4/c8_broy_elpa.inp
  101. +0 −1 tests/QS/regtest-gpw-6-4/c8_broy_gapw.inp
  102. +0 −1 tests/QS/regtest-gpw-6-4/c8_broy_gapw_gop.inp
  103. +0 −1 tests/QS/regtest-gpw-6-4/c8_broy_gop.inp
  104. +0 −1 tests/QS/regtest-gpw-6-4/c8_kerker_gapw.inp
  105. +0 −1 tests/QS/regtest-gpw-7/si8_broy_kry.inp
  106. +0 −1 tests/QS/regtest-gpw-7/si8_broy_kry_r.inp
  107. +0 −1 tests/QS/regtest-gpw-7/si8_broy_lsd.inp
  108. +0 −1 tests/QS/regtest-gpw-7/si8_pmix_otdiag.inp
  109. +0 −1 tests/QS/regtest-gpw-8/bug_ai_moments.inp
  110. +0 −1 tests/QS/regtest-gpw-8/si8_broy_ch.inp
  111. +0 −1 tests/QS/regtest-gpw-8/si8_broy_dav_md.inp
  112. +0 −1 tests/QS/regtest-gpw-8/si8_broy_dav_t300.inp
  113. +0 −1 tests/QS/regtest-gpw-8/si8_broy_dav_t300_lsd.inp
  114. +0 −1 tests/QS/regtest-gpw-8/si8_broy_dav_t300_r.inp
  115. +0 −1 tests/QS/regtest-gpw-8/si8_broy_dav_t5000_r.inp
  116. +0 −1 tests/QS/regtest-gpw-8/si8_broy_davsparse_md.inp
  117. +0 −1 tests/QS/regtest-gpw-8/si8_broy_std_md.inp
  118. +0 −1 tests/QS/regtest-gpw-8/si8_broy_stm.inp
  119. +0 −1 tests/QS/regtest-gpw-8/si8_broy_wc.inp
  120. +0 −1 tests/QS/regtest-gpw-8/si8_broy_wc_crazy.inp
  121. +0 −1 tests/QS/regtest-gpw-8/si8_broy_wc_crazy_ene.inp
  122. +0 −1 tests/QS/regtest-hfx-2/H2O-c.inp
  123. +0 −1 tests/QS/regtest-hfx-2/H2O-lsd-c.inp
  124. +0 −1 tests/QS/regtest-hfx-2/H2O-lsd-c_ic.inp
  125. +0 −1 tests/QS/regtest-hfx-2/H2O-lsd-sl.inp
  126. +0 −1 tests/QS/regtest-hfx-2/H2O-lsd-sl_ic.inp
  127. +0 −1 tests/QS/regtest-hfx-2/H2O-sl.inp
  128. +0 −1 tests/QS/regtest-hfx/H2O-hfx-emd-ngs.inp
  129. +0 −1 tests/QS/regtest-hfx/H2O-hfx-emd-restart.inp
  130. +0 −1 tests/QS/regtest-hfx/H2O-hfx-emd.inp
  131. +0 −1 tests/QS/regtest-hfx/H2O-hfx-ls-emd-bch.inp
  132. +0 −1 tests/QS/regtest-hfx/H2O-hfx-ls-emd-ngs.inp
  133. +0 −1 tests/QS/regtest-hfx/H2O-hfx-ls-emd.inp
  134. +0 −1 tests/QS/regtest-hfx/H2O-hfx-ls-rtp-bch.inp
  135. +0 −1 tests/QS/regtest-hfx/H2O-hfx-ls-rtp.inp
  136. +0 −1 tests/QS/regtest-hybrid-2/NE-hybrid-HSE03-lda.inp
  137. +0 −1 tests/QS/regtest-hybrid-2/NE-hybrid-HSE06-lda.inp
  138. +0 −1 tests/QS/regtest-kp-1/c_gapw.inp
  139. +0 −1 tests/QS/regtest-kp-1/c_gapwxc.inp
  140. +0 −1 tests/QS/regtest-kp-2/Al_1_4.inp
  141. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-ewindow.inp
  142. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-mcweeny-rt-restart.inp
  143. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-mcweeny.inp
  144. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-mixing.inp
  145. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-ngs.inp
  146. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd-scf-restart.inp
  147. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-emd.inp
  148. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-rtp-bch.inp
  149. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-rtp-scf-restart.inp
  150. +0 −1 tests/QS/regtest-ls-rtp/H2O-ls-rtp.inp
  151. +0 −1 tests/QS/regtest-ls-rtp/H2plus-ls-rtp.inp
  152. +0 −1 tests/QS/regtest-ls-rtp/H2plus-ls-rtp2.inp
  153. +0 −1 tests/QS/regtest-ls-rtp/emd-KG.inp
  154. +0 −1 tests/QS/regtest-nonortho/graph_b111.inp
  155. +0 −1 tests/QS/regtest-nonortho/graph_b111_gapw.inp
  156. +0 −1 tests/QS/regtest-nonortho/graphite-lumo.inp
  157. +0 −1 tests/QS/regtest-nonortho/graphite.inp
  158. +0 −1 tests/QS/regtest-nonortho/graphite2.inp
  159. +0 −1 tests/QS/regtest-nonortho/graphite3.inp
  160. +0 −1 tests/QS/regtest-optbas/H2O-ref.inp
  161. +0 −1 tests/QS/regtest-ot-1/H2-1.inp
  162. +0 −1 tests/QS/regtest-ot-1/H2-2.inp
  163. +0 −1 tests/QS/regtest-ot-1/H2-3.inp
  164. +0 −1 tests/QS/regtest-ot/C2H4-elf.inp
  165. +0 −1 tests/QS/regtest-ot/C2H4-init.inp
  166. +0 −1 tests/QS/regtest-ot/C2H4.inp
  167. +0 −1 tests/QS/regtest-ot/H2-BECKE-MD.inp
  168. +0 −2 tests/QS/regtest-ot/H2-diffBECKE-ET_coupling.inp
  169. +0 −1 tests/QS/regtest-ot/H2O-geo-dos-1.inp
  170. +0 −1 tests/QS/regtest-ot/H2O-geo-dos-2.inp
  171. +0 −1 tests/QS/regtest-ot/H2O-geo-ot-evals.inp
  172. +0 −1 tests/QS/regtest-ot/H2O-geo-ot-lumo-all.inp
  173. +0 −1 tests/QS/regtest-ot/H2O-geo-ot-mols.inp
  174. +0 −1 tests/QS/regtest-ot/H2O-geo-ot-pdos-lumo-comp.inp
  175. +0 −1 tests/QS/regtest-ot/H2O-geo-ot-pdos.inp
  176. +0 −1 tests/QS/regtest-ot/H2O-geo-pdos.inp
  177. +0 −1 tests/QS/regtest-ot/H2O-geo-pdos_comp.inp
  178. +0 −1 tests/QS/regtest-ot/H2O-geo-pdos_comp_list.inp
  179. +0 −1 tests/QS/regtest-ot/He2_ddapc_constraint-2.inp
  180. +0 −1 tests/QS/regtest-ot/He2_ddapc_constraint-3.inp
  181. +0 −1 tests/QS/regtest-ot/He2_ddapc_constraint-4.inp
  182. +0 −1 tests/QS/regtest-ot/He2_ddapc_constraint.inp
  183. +0 −1 tests/QS/regtest-ot/He2_lumos.inp
  184. +0 −1 tests/QS/regtest-ot/He2_none.inp
  185. +0 −1 tests/QS/regtest-ot/He2_none_full_all.inp
  186. +0 −1 tests/QS/regtest-ot/He2_none_full_inverse.inp
  187. +0 −1 tests/QS/regtest-ot/He2_none_full_single.inp
  188. +0 −1 tests/QS/regtest-ot/He_a_x.inp
  189. +0 −1 tests/QS/regtest-ot/He_a_xy.inp
  190. +0 −1 tests/QS/regtest-ot/He_a_xyz.inp
  191. +0 −1 tests/QS/regtest-ot/He_a_xz.inp
  192. +0 −1 tests/QS/regtest-ot/He_a_y.inp
  193. +0 −1 tests/QS/regtest-ot/He_a_yz.inp
  194. +0 −1 tests/QS/regtest-ot/He_a_z.inp
  195. +0 −1 tests/QS/regtest-ot/sic_ddapc_rt.inp
  196. +0 −1 tests/QS/regtest-ot/sic_energy.inp
  197. +0 −1 tests/QS/regtest-p-efield/H2O-field-gopt-lsd.inp
  198. +0 −1 tests/QS/regtest-p-efield/H2O-field-gopt.inp
  199. +0 −1 tests/QS/regtest-p-efield/H2O-field-lsd.inp
  200. +0 −1 tests/QS/regtest-p-efield/H2O-field.inp
  201. +0 −1 tests/QS/regtest-p-efield/HF-dfield-debug.inp
  202. +0 −1 tests/QS/regtest-p-efield/HF-dfield-gopt.inp
  203. +0 −1 tests/QS/regtest-p-efield/HF-dfield.inp
  204. +0 −1 tests/QS/regtest-p-efield/HF-dfilter-debug.inp
  205. +0 −1 tests/QS/regtest-p-efield/HF-field-debug.inp
  206. +0 −1 tests/QS/regtest-p-efield/HF-field-gopt.inp
  207. +0 −1 tests/QS/regtest-p-efield/HF-field.inp
  208. +0 −1 tests/QS/regtest-p-efield/HF-loc-field-debug.inp
  209. +0 −1 tests/QS/regtest-p-efield/HF-loc-field-gopt.inp
  210. +0 −1 tests/QS/regtest-p-efield/HF-loc-field.inp
  211. +0 −1 tests/QS/regtest-plus_u/H2O-rks-diag-lowdin.inp
  212. +0 −1 tests/QS/regtest-plus_u/H2O-rks-diag-mulliken.inp
  213. +0 −1 tests/QS/regtest-plus_u/H2O-rks-diag.inp
  214. +0 −1 tests/QS/regtest-plus_u/H2O-rks-otcg-lowdin.inp
  215. +0 −1 tests/QS/regtest-plus_u/H2O-rks-otcg-mulliken.inp
  216. +0 −1 tests/QS/regtest-plus_u/H2O-rks-otcg.inp
  217. +0 −1 tests/QS/regtest-plus_u/H2O-rks-u_ramping.inp
  218. +0 −1 tests/QS/regtest-plus_u/H2O-rks-u_ramping_reset.inp
  219. +0 −1 tests/QS/regtest-plus_u/H2O-uks-diag-lowdin.inp
  220. +0 −1 tests/QS/regtest-plus_u/H2O-uks-diag-mulliken.inp
  221. +0 −1 tests/QS/regtest-plus_u/H2O-uks-diag.inp
  222. +0 −1 tests/QS/regtest-plus_u/H2O-uks-otcg-lowdin.inp
  223. +0 −1 tests/QS/regtest-plus_u/H2O-uks-otcg-mulliken.inp
  224. +0 −1 tests/QS/regtest-plus_u/H2O-uks-otcg.inp
  225. +0 −1 tests/QS/regtest-plus_u/H2O-uks-u_ramping.inp
  226. +0 −1 tests/QS/regtest-plus_u/H2O-uks-u_ramping_reset.inp
  227. +0 −1 tests/QS/regtest-pod/ethylene-pbe-4A.inp
  228. +0 −1 tests/QS/regtest-pod/ethylene-pbe-4A_ot.inp
  229. +0 −1 tests/QS/regtest-pod/furane-pbe-4A.inp
  230. +0 −1 tests/QS/regtest-pod/hellium-pbe-3A.inp
  231. +0 −1 tests/QS/regtest-pod/hellium-pbe-4A.inp
  232. +0 −1 tests/QS/regtest-pod/hellium-pbe-5A.inp
  233. +0 −1 tests/QS/regtest-properties/resp/CH3OH_nonperiodic.inp
  234. +0 −1 tests/QS/regtest-properties/resp/CH3OH_periodic.inp
  235. +0 −1 tests/QS/regtest-properties/resp/CH3OH_periodic_repeat.inp
  236. +0 −1 tests/QS/regtest-properties/resp/graphite.inp
  237. +0 −1 tests/QS/regtest-properties/resp/graphite_REPEAT.inp
  238. +0 −1 tests/QS/regtest-rtp-1/H2-emd.inp
  239. +0 −1 tests/QS/regtest-rtp-1/H2-rtp.inp
  240. +0 −1 tests/QS/regtest-rtp-1/H2plus-emd-1.inp
  241. +0 −1 tests/QS/regtest-rtp-1/H2plus-emd.inp
  242. +0 −1 tests/QS/regtest-rtp-1/H2plus-rtp-1.inp
  243. +0 −1 tests/QS/regtest-rtp-1/H2plus-rtp.inp
  244. +0 −1 tests/QS/regtest-rtp-2/H2-emd-efield-custom.inp
  245. +0 −1 tests/QS/regtest-rtp-2/H2-emd-efield-ramp.inp
  246. +0 −1 tests/QS/regtest-rtp-2/H2-emd-efield.inp
  247. +0 −1 tests/QS/regtest-rtp-2/H2-emd_CN.inp
  248. +0 −1 tests/QS/regtest-rtp-2/H2-emd_EM.inp
  249. +0 −1 tests/QS/regtest-rtp-2/H2-emd_ETRS_ARNOLDI.inp
  250. +0 −1 tests/QS/regtest-rtp-2/H2-emd_ETRS_PADE.inp
  251. +0 −1 tests/QS/regtest-rtp-2/H2-emd_restart-1.inp
  252. +0 −1 tests/QS/regtest-rtp-2/H2-emd_restart.inp
  253. +0 −1 tests/QS/regtest-rtp-2/H2-rtp-efield.inp
  254. +0 −1 tests/QS/regtest-rtp-2/H2-rtp_CN.inp
  255. +0 −1 tests/QS/regtest-rtp-2/H2-rtp_ETRS_ARNOLDI.inp
  256. +0 −1 tests/QS/regtest-rtp-2/H2-rtp_ETRS_PADE.inp
  257. +0 −1 tests/QS/regtest-rtp-2/H2-rtp_restart-1.inp
  258. +0 −1 tests/QS/regtest-rtp-2/H2-rtp_restart.inp
  259. +0 −1 tests/QS/regtest-slab/hbn3_1h2o_dipcor_ff.inp
  260. +0 −1 tests/QS/regtest-slab/hbn3_1h2o_dipcor_ff_pyz.inp
  261. +0 −1 tests/QS/regtest-slab/hbn3_1h2o_ff.inp
  262. +0 −1 tests/QS/regtest-slab/hbn3_1h2o_ff_pyz.inp
  263. +0 −1 tests/QS/regtest-slab/hbn3_1h2o_ff_pyz_2dps.inp
  264. +0 −1 tests/QS/regtest-stress/LiH-stress-lda-rks.inp
  265. +0 −1 tests/QS/regtest-stress/LiH-stress-lda-uks.inp
  266. +0 −1 tests/QS/regtest-stress/LiH-stress-pbe-rks.inp
  267. +0 −1 tests/QS/regtest-stress/LiH-stress-pbe-uks.inp
  268. +0 −1 tests/QS/regtest-stress/SiC-stress-pbe-nlcc.inp
@@ -13,7 +13,6 @@
&QS
EPS_DEFAULT 1.0E-6
EPS_FILTER_MATRIX 0.0E0
MAP_CONSISTENT
&END QS
&SCF
SCF_GUESS ATOMIC
@@ -12,7 +12,6 @@
&END MGRID
&QS
EPS_DEFAULT 1.0E-8
MAP_CONSISTENT
&END QS
&SCF
SCF_GUESS ATOMIC
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&SE
&END SE
EPS_DEFAULT 1.0E-8
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 2
&END QS
@@ -22,7 +22,6 @@
&END MGRID
&QS
EPS_DEFAULT 1.0E-10
MAP_CONSISTENT
&END QS
&POISSON
PERIODIC NONE
@@ -29,7 +29,6 @@
EXTRAPOLATION USE_PREV_P
LMAXN0 2
LMAXN1 6
MAP_CONSISTENT
METHOD GAPW
QUADRATURE GC_LOG
&END QS
@@ -26,7 +26,6 @@
EXTRAPOLATION USE_PREV_P
LMAXN0 2
LMAXN1 6
MAP_CONSISTENT
METHOD GAPW
QUADRATURE GC_LOG
&END QS
@@ -31,7 +31,6 @@
EXTRAPOLATION USE_PREV_P
LMAXN0 2
LMAXN1 6
MAP_CONSISTENT
METHOD GAPW
QUADRATURE GC_LOG
&END QS
@@ -21,7 +21,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -21,7 +21,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -22,7 +22,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -22,7 +22,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -1,7 +1,6 @@
&QS
METHOD GAPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GAPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -6,7 +6,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&END QS
@@ -1,7 +1,6 @@
&QS
METHOD GPW
EPS_DEFAULT 1.0E-12
MAP_CONSISTENT
EXTRAPOLATION ASPC
EXTRAPOLATION_ORDER 3
&CDFT
@@ -36,7 +36,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -34,7 +34,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -29,7 +29,6 @@
&END MGRID
&QS
METHOD GPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -21,7 +21,6 @@
&END MGRID
&QS
METHOD GAPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -21,7 +21,6 @@
&END MGRID
&QS
METHOD GAPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS
@@ -21,7 +21,6 @@
&END MGRID
&QS
METHOD GAPW
MAP_CONSISTENT
EXTRAPOLATION PS
EXTRAPOLATION_ORDER 2
&END QS

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