Created
February 27, 2026 16:57
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(partial) EasyBuild log for failed build of /tmp/eb-r4opdlrj/files_pr25133/l/LAMMPS/LAMMPS-29Aug2024_update2-foss-2024a-kokkos.eb (PR(s) #25133)
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| Start 385: BondStyle:gromos | |
| 340/545 Test #385: BondStyle:gromos .............................. Passed 1.26 sec | |
| Start 386: BondStyle:harmonic | |
| 341/545 Test #386: BondStyle:harmonic ............................ Passed 1.24 sec | |
| Start 387: BondStyle:harmonic_restrain | |
| 342/545 Test #387: BondStyle:harmonic_restrain ................... Passed 1.36 sec | |
| Start 388: BondStyle:harmonic_shift | |
| 343/545 Test #388: BondStyle:harmonic_shift ...................... Passed 1.26 sec | |
| Start 389: BondStyle:harmonic_shift_cut | |
| 344/545 Test #389: BondStyle:harmonic_shift_cut .................. Passed 1.23 sec | |
| Start 390: BondStyle:hybrid | |
| 345/545 Test #390: BondStyle:hybrid .............................. Passed 1.37 sec | |
| Start 391: BondStyle:lepton | |
| 346/545 Test #391: BondStyle:lepton .............................. Passed 1.42 sec | |
| Start 392: BondStyle:lepton_nooffset | |
| 347/545 Test #392: BondStyle:lepton_nooffset ..................... Passed 1.39 sec | |
| Start 393: BondStyle:mm3 | |
| 348/545 Test #393: BondStyle:mm3 ................................. Passed 1.37 sec | |
| Start 394: BondStyle:morse | |
| 349/545 Test #394: BondStyle:morse ............................... Passed 1.26 sec | |
| Start 395: BondStyle:nonlinear | |
| 350/545 Test #395: BondStyle:nonlinear ........................... Passed 1.23 sec | |
| Start 396: BondStyle:quartic | |
| 351/545 Test #396: BondStyle:quartic ............................. Passed 1.37 sec | |
| Start 397: BondStyle:table_linear | |
| 352/545 Test #397: BondStyle:table_linear ........................ Passed 1.27 sec | |
| Start 398: BondStyle:table_spline | |
| 353/545 Test #398: BondStyle:table_spline ........................ Passed 1.24 sec | |
| Start 399: BondStyle:zero | |
| 354/545 Test #399: BondStyle:zero ................................ Passed 1.36 sec | |
| Start 400: AngleStyle:amoeba | |
| 355/545 Test #400: AngleStyle:amoeba ............................. Passed 1.25 sec | |
| Start 401: AngleStyle:charmm | |
| 356/545 Test #401: AngleStyle:charmm ............................. Passed 1.25 sec | |
| Start 402: AngleStyle:class2 | |
| 357/545 Test #402: AngleStyle:class2 ............................. Passed 1.39 sec | |
| Start 403: AngleStyle:class2_p6 | |
| 358/545 Test #403: AngleStyle:class2_p6 .......................... Passed 1.25 sec | |
| Start 404: AngleStyle:cosine | |
| 359/545 Test #404: AngleStyle:cosine ............................. Passed 1.24 sec | |
| Start 405: AngleStyle:cosine_delta | |
| 360/545 Test #405: AngleStyle:cosine_delta ....................... Passed 1.38 sec | |
| Start 406: AngleStyle:cosine_periodic | |
| 361/545 Test #406: AngleStyle:cosine_periodic .................... Passed 1.26 sec | |
| Start 407: AngleStyle:cosine_shift | |
| 362/545 Test #407: AngleStyle:cosine_shift ....................... Passed 1.23 sec | |
| Start 408: AngleStyle:cosine_shift_exp | |
| 363/545 Test #408: AngleStyle:cosine_shift_exp ................... Passed 1.37 sec | |
| Start 409: AngleStyle:cosine_squared | |
| 364/545 Test #409: AngleStyle:cosine_squared ..................... Passed 1.26 sec | |
| Start 410: AngleStyle:cosine_squared_restricted | |
| 365/545 Test #410: AngleStyle:cosine_squared_restricted .......... Passed 1.23 sec | |
| Start 411: AngleStyle:cross | |
| 366/545 Test #411: AngleStyle:cross .............................. Passed 1.36 sec | |
| Start 412: AngleStyle:dipole | |
| 367/545 Test #412: AngleStyle:dipole ............................. Passed 1.25 sec | |
| Start 413: AngleStyle:fourier | |
| 368/545 Test #413: AngleStyle:fourier ............................ Passed 1.23 sec | |
| Start 414: AngleStyle:fourier_simple | |
| 369/545 Test #414: AngleStyle:fourier_simple ..................... Passed 1.37 sec | |
| Start 415: AngleStyle:gaussian | |
| 370/545 Test #415: AngleStyle:gaussian ........................... Passed 1.25 sec | |
| Start 416: AngleStyle:harmonic | |
| 371/545 Test #416: AngleStyle:harmonic ........................... Passed 1.25 sec | |
| Start 417: AngleStyle:hybrid | |
| 372/545 Test #417: AngleStyle:hybrid ............................. Passed 1.37 sec | |
| Start 418: AngleStyle:lepton | |
| 373/545 Test #418: AngleStyle:lepton ............................. Passed 1.33 sec | |
| Start 419: AngleStyle:lepton_nooffset | |
| 374/545 Test #419: AngleStyle:lepton_nooffset .................... Passed 1.30 sec | |
| Start 420: AngleStyle:mm3 | |
| 375/545 Test #420: AngleStyle:mm3 ................................ Passed 1.37 sec | |
| Start 421: AngleStyle:quartic | |
| 376/545 Test #421: AngleStyle:quartic ............................ Passed 1.26 sec | |
| Start 422: AngleStyle:spica | |
| 377/545 Test #422: AngleStyle:spica .............................. Passed 1.26 sec | |
| Start 423: AngleStyle:table_linear | |
| 378/545 Test #423: AngleStyle:table_linear ....................... Passed 1.37 sec | |
| Start 424: AngleStyle:table_spline | |
| 379/545 Test #424: AngleStyle:table_spline ....................... Passed 1.27 sec | |
| Start 425: AngleStyle:zero | |
| 380/545 Test #425: AngleStyle:zero ............................... Passed 1.22 sec | |
| Start 426: KSpaceStyle:ewald | |
| 381/545 Test #426: KSpaceStyle:ewald ............................. Passed 1.37 sec | |
| Start 427: KSpaceStyle:ewald_conp_charge | |
| 382/545 Test #427: KSpaceStyle:ewald_conp_charge ................. Passed 1.30 sec | |
| Start 428: KSpaceStyle:ewald_dipole | |
| 383/545 Test #428: KSpaceStyle:ewald_dipole ...................... Passed 1.22 sec | |
| Start 429: KSpaceStyle:ewald_disp | |
| 384/545 Test #429: KSpaceStyle:ewald_disp ........................ Passed 1.37 sec | |
| Start 430: KSpaceStyle:ewald_disp_dipole | |
| 385/545 Test #430: KSpaceStyle:ewald_disp_dipole ................. Passed 1.25 sec | |
| Start 431: KSpaceStyle:ewald_electrode_slab | |
| 386/545 Test #431: KSpaceStyle:ewald_electrode_slab .............. Passed 1.24 sec | |
| Start 432: KSpaceStyle:ewald_nozforce | |
| 387/545 Test #432: KSpaceStyle:ewald_nozforce .................... Passed 1.38 sec | |
| Start 433: KSpaceStyle:ewald_slab | |
| 388/545 Test #433: KSpaceStyle:ewald_slab ........................ Passed 1.27 sec | |
| Start 434: KSpaceStyle:ewald_tilted | |
| 389/545 Test #434: KSpaceStyle:ewald_tilted ...................... Passed 1.24 sec | |
| Start 435: KSpaceStyle:ewald_tri | |
| 390/545 Test #435: KSpaceStyle:ewald_tri ......................... Passed 1.38 sec | |
| Start 436: KSpaceStyle:msm | |
| 391/545 Test #436: KSpaceStyle:msm ............................... Passed 1.60 sec | |
| Start 437: KSpaceStyle:msm_cg | |
| 392/545 Test #437: KSpaceStyle:msm_cg ............................ Passed 1.72 sec | |
| Start 438: KSpaceStyle:msm_dielectric | |
| 393/545 Test #438: KSpaceStyle:msm_dielectric .................... Passed 1.23 sec | |
| Start 439: KSpaceStyle:msm_nopbc | |
| 394/545 Test #439: KSpaceStyle:msm_nopbc ......................... Passed 2.31 sec | |
| Start 440: KSpaceStyle:pppm | |
| 395/545 Test #440: KSpaceStyle:pppm .............................. Passed 1.31 sec | |
| Start 441: KSpaceStyle:pppm_ad | |
| 396/545 Test #441: KSpaceStyle:pppm_ad ........................... Passed 1.47 sec | |
| Start 442: KSpaceStyle:pppm_cg | |
| 397/545 Test #442: KSpaceStyle:pppm_cg ........................... Passed 1.26 sec | |
| Start 443: KSpaceStyle:pppm_cg_ad | |
| 398/545 Test #443: KSpaceStyle:pppm_cg_ad ........................ Passed 1.41 sec | |
| Start 444: KSpaceStyle:pppm_cg_tiled | |
| 399/545 Test #444: KSpaceStyle:pppm_cg_tiled ..................... Passed 1.41 sec | |
| Start 445: KSpaceStyle:pppm_conp_charge | |
| 400/545 Test #445: KSpaceStyle:pppm_conp_charge .................. Passed 1.62 sec | |
| Start 446: KSpaceStyle:pppm_dielectric | |
| 401/545 Test #446: KSpaceStyle:pppm_dielectric ................... Passed 1.42 sec | |
| Start 447: KSpaceStyle:pppm_dipole | |
| 402/545 Test #447: KSpaceStyle:pppm_dipole ....................... Passed 5.51 sec | |
| Start 448: KSpaceStyle:pppm_disp | |
| 403/545 Test #448: KSpaceStyle:pppm_disp ......................... Passed 3.96 sec | |
| Start 449: KSpaceStyle:pppm_disp_ad | |
| 404/545 Test #449: KSpaceStyle:pppm_disp_ad ...................... Passed 5.23 sec | |
| Start 450: KSpaceStyle:pppm_disp_ad_only | |
| 405/545 Test #450: KSpaceStyle:pppm_disp_ad_only ................. Passed 1.42 sec | |
| Start 451: KSpaceStyle:pppm_disp_dielectric | |
| 406/545 Test #451: KSpaceStyle:pppm_disp_dielectric .............. Passed 2.64 sec | |
| Start 452: KSpaceStyle:pppm_disp_only | |
| 407/545 Test #452: KSpaceStyle:pppm_disp_only .................... Passed 1.42 sec | |
| Start 453: KSpaceStyle:pppm_disp_tip4p | |
| 408/545 Test #453: KSpaceStyle:pppm_disp_tip4p ................... Passed 3.32 sec | |
| Start 454: KSpaceStyle:pppm_electrode_slab | |
| 409/545 Test #454: KSpaceStyle:pppm_electrode_slab ............... Passed 1.45 sec | |
| Start 455: KSpaceStyle:pppm_nozforce | |
| 410/545 Test #455: KSpaceStyle:pppm_nozforce ..................... Passed 1.27 sec | |
| Start 456: KSpaceStyle:pppm_slab | |
| 411/545 Test #456: KSpaceStyle:pppm_slab ......................... Passed 1.30 sec | |
| Start 457: KSpaceStyle:pppm_stagger | |
| 412/545 Test #457: KSpaceStyle:pppm_stagger ...................... Passed 2.25 sec | |
| Start 458: KSpaceStyle:pppm_stagger_tiled | |
| 413/545 Test #458: KSpaceStyle:pppm_stagger_tiled ................ Passed 2.37 sec | |
| Start 459: KSpaceStyle:pppm_tiled | |
| 414/545 Test #459: KSpaceStyle:pppm_tiled ........................ Passed 1.45 sec | |
| Start 460: KSpaceStyle:pppm_tilted | |
| 415/545 Test #460: KSpaceStyle:pppm_tilted ....................... Passed 1.30 sec | |
| Start 461: KSpaceStyle:pppm_tip4p | |
| 416/545 Test #461: KSpaceStyle:pppm_tip4p ........................ Passed 1.24 sec | |
| Start 462: KSpaceStyle:pppm_tip4p_ad | |
| 417/545 Test #462: KSpaceStyle:pppm_tip4p_ad ..................... Passed 1.51 sec | |
| Start 463: KSpaceStyle:pppm_tip4p_nozforce | |
| 418/545 Test #463: KSpaceStyle:pppm_tip4p_nozforce ............... Passed 1.24 sec | |
| Start 464: KSpaceStyle:pppm_tip4p_slab | |
| 419/545 Test #464: KSpaceStyle:pppm_tip4p_slab ................... Passed 1.25 sec | |
| Start 465: KSpaceStyle:pppm_tri | |
| 420/545 Test #465: KSpaceStyle:pppm_tri .......................... Passed 1.44 sec | |
| Start 466: FixTimestep:adapt_coul | |
| 421/545 Test #466: FixTimestep:adapt_coul ........................ Passed 1.23 sec | |
| Start 467: FixTimestep:adapt_hybrid | |
| 422/545 Test #467: FixTimestep:adapt_hybrid ...................... Passed 1.22 sec | |
| Start 468: FixTimestep:adapt_pair | |
| 423/545 Test #468: FixTimestep:adapt_pair ........................ Passed 1.39 sec | |
| Start 469: FixTimestep:addforce_const | |
| 424/545 Test #469: FixTimestep:addforce_const .................... Passed 1.21 sec | |
| Start 470: FixTimestep:addforce_variable | |
| 425/545 Test #470: FixTimestep:addforce_variable ................. Passed 1.21 sec | |
| Start 471: FixTimestep:addtorque_const | |
| 426/545 Test #471: FixTimestep:addtorque_const ................... Passed 1.38 sec | |
| Start 472: FixTimestep:addtorque_variable | |
| 427/545 Test #472: FixTimestep:addtorque_variable ................ Passed 1.22 sec | |
| Start 473: FixTimestep:aveforce_const | |
| 428/545 Test #473: FixTimestep:aveforce_const .................... Passed 1.22 sec | |
| Start 474: FixTimestep:aveforce_variable | |
| 429/545 Test #474: FixTimestep:aveforce_variable ................. Passed 1.38 sec | |
| Start 475: FixTimestep:brownian | |
| 430/545 Test #475: FixTimestep:brownian .......................... Passed 1.20 sec | |
| Start 476: FixTimestep:deform | |
| 431/545 Test #476: FixTimestep:deform ............................ Passed 1.21 sec | |
| Start 477: FixTimestep:deform_noremap | |
| 432/545 Test #477: FixTimestep:deform_noremap .................... Passed 1.39 sec | |
| Start 478: FixTimestep:deform_tri | |
| 433/545 Test #478: FixTimestep:deform_tri ........................***Failed 1.22 sec | |
| No PMIx server was reachable, but a PMI1/2 was detected. | |
| If srun is being used to launch application, 16 singletons will be started. | |
| [==========] Running 2 tests from 1 test suite. | |
| [----------] Global test environment set-up. | |
| [----------] 2 tests from FixTimestep | |
| [ RUN ] FixTimestep.plain | |
| /tmp/boegel/LAMMPS/29Aug2024_update2/foss-2024a-kokkos/lammps-stable_29Aug2024_update2/unittest/force-styles/test_main.cpp:98: Failure | |
| Expected: (err) <= (epsilon) | |
| Actual: 1.218982305409077e-12 vs 4.9999999999999999e-13 | |
| Google Test trace: | |
| /tmp/boegel/LAMMPS/29Aug2024_update2/foss-2024a-kokkos/lammps-stable_29Aug2024_update2/unittest/force-styles/test_main.cpp:90: EXPECT_VELOCITIES: run_vel (normal run, verlet) | |
| [ FAILED ] FixTimestep.plain (13 ms) | |
| [ RUN ] FixTimestep.omp | |
| One or more prerequisite styles with /omp suffix are not available in this LAMMPS configuration: | |
| atom_style full | |
| fix_style deform/omp | |
| /tmp/boegel/LAMMPS/29Aug2024_update2/foss-2024a-kokkos/lammps-stable_29Aug2024_update2/unittest/force-styles/test_fix_timestep.cpp:596: Skipped | |
| [ SKIPPED ] FixTimestep.omp (1 ms) | |
| [----------] 2 tests from FixTimestep (14 ms total) | |
| [----------] Global test environment tear-down | |
| [==========] 2 tests from 1 test suite ran. (14 ms total) | |
| [ PASSED ] 0 tests. | |
| [ SKIPPED ] 1 test, listed below: | |
| [ SKIPPED ] FixTimestep.omp | |
| [ FAILED ] 1 test, listed below: | |
| [ FAILED ] FixTimestep.plain | |
| 1 FAILED TEST | |
| Start 479: FixTimestep:drag | |
| 434/545 Test #479: FixTimestep:drag .............................. Passed 1.21 sec | |
| Start 480: FixTimestep:efield_const | |
| 435/545 Test #480: FixTimestep:efield_const ...................... Passed 1.38 sec | |
| Start 481: FixTimestep:efield_region | |
| 436/545 Test #481: FixTimestep:efield_region ..................... Passed 1.21 sec | |
| Start 482: FixTimestep:efield_tip4p_const | |
| 437/545 Test #482: FixTimestep:efield_tip4p_const ................ Passed 1.21 sec | |
| Start 483: FixTimestep:efield_tip4p_variable | |
| 438/545 Test #483: FixTimestep:efield_tip4p_variable ............. Passed 1.39 sec | |
| Start 484: FixTimestep:efield_variable | |
| 439/545 Test #484: FixTimestep:efield_variable ................... Passed 1.22 sec | |
| Start 485: FixTimestep:heat | |
| 440/545 Test #485: FixTimestep:heat .............................. Passed 1.21 sec | |
| Start 486: FixTimestep:heat_region | |
| 441/545 Test #486: FixTimestep:heat_region ....................... Passed 1.38 sec | |
| Start 487: FixTimestep:lineforce | |
| 442/545 Test #487: FixTimestep:lineforce ......................... Passed 1.22 sec | |
| Start 488: FixTimestep:momentum | |
| 443/545 Test #488: FixTimestep:momentum .......................... Passed 1.21 sec | |
| Start 489: FixTimestep:momentum_chunk | |
| 444/545 Test #489: FixTimestep:momentum_chunk .................... Passed 1.39 sec | |
| Start 490: FixTimestep:move_linear | |
| 445/545 Test #490: FixTimestep:move_linear ....................... Passed 1.21 sec | |
| Start 491: FixTimestep:move_rotate | |
| 446/545 Test #491: FixTimestep:move_rotate ....................... Passed 1.22 sec | |
| Start 492: FixTimestep:move_transrot | |
| 447/545 Test #492: FixTimestep:move_transrot ..................... Passed 1.38 sec | |
| Start 493: FixTimestep:move_variable | |
| 448/545 Test #493: FixTimestep:move_variable ..................... Passed 1.22 sec | |
| Start 494: FixTimestep:move_wiggle | |
| 449/545 Test #494: FixTimestep:move_wiggle ....................... Passed 1.21 sec | |
| Start 495: FixTimestep:nph | |
| 450/545 Test #495: FixTimestep:nph ............................... Passed 1.39 sec | |
| Start 496: FixTimestep:nph_sphere | |
| 451/545 Test #496: FixTimestep:nph_sphere ........................ Passed 1.22 sec | |
| Start 497: FixTimestep:npt_aniso | |
| 452/545 Test #497: FixTimestep:npt_aniso ......................... Passed 1.23 sec | |
| Start 498: FixTimestep:npt_iso | |
| 453/545 Test #498: FixTimestep:npt_iso ........................... Passed 1.40 sec | |
| Start 499: FixTimestep:npt_sphere_aniso | |
| 454/545 Test #499: FixTimestep:npt_sphere_aniso .................. Passed 1.22 sec | |
| Start 500: FixTimestep:npt_sphere_iso | |
| 455/545 Test #500: FixTimestep:npt_sphere_iso .................... Passed 1.22 sec | |
| Start 501: FixTimestep:npt_sphere_tri | |
| 456/545 Test #501: FixTimestep:npt_sphere_tri .................... Passed 1.39 sec | |
| Start 502: FixTimestep:npt_tri | |
| 457/545 Test #502: FixTimestep:npt_tri ........................... Passed 1.23 sec | |
| Start 503: FixTimestep:nve | |
| 458/545 Test #503: FixTimestep:nve ............................... Passed 1.23 sec | |
| Start 504: FixTimestep:nve_limit | |
| 459/545 Test #504: FixTimestep:nve_limit ......................... Passed 1.38 sec | |
| Start 505: FixTimestep:nve_noforce | |
| 460/545 Test #505: FixTimestep:nve_noforce ....................... Passed 1.22 sec | |
| Start 506: FixTimestep:nve_sphere | |
| 461/545 Test #506: FixTimestep:nve_sphere ........................ Passed 1.22 sec | |
| Start 507: FixTimestep:nve_sphere_dipole | |
| 462/545 Test #507: FixTimestep:nve_sphere_dipole ................. Passed 1.39 sec | |
| Start 508: FixTimestep:nve_sphere_dipole_dlm | |
| 463/545 Test #508: FixTimestep:nve_sphere_dipole_dlm ............. Passed 1.22 sec | |
| Start 509: FixTimestep:nvt-psllod | |
| 464/545 Test #509: FixTimestep:nvt-psllod ........................ Passed 1.23 sec | |
| Start 510: FixTimestep:nvt-sllod | |
| 465/545 Test #510: FixTimestep:nvt-sllod ......................... Passed 1.39 sec | |
| Start 511: FixTimestep:nvt | |
| 466/545 Test #511: FixTimestep:nvt ............................... Passed 1.23 sec | |
| Start 512: FixTimestep:nvt_drag | |
| 467/545 Test #512: FixTimestep:nvt_drag .......................... Passed 1.23 sec | |
| Start 513: FixTimestep:nvt_mtk | |
| 468/545 Test #513: FixTimestep:nvt_mtk ........................... Passed 1.40 sec | |
| Start 514: FixTimestep:nvt_sphere | |
| 469/545 Test #514: FixTimestep:nvt_sphere ........................ Passed 1.22 sec | |
| Start 515: FixTimestep:oneway | |
| 470/545 Test #515: FixTimestep:oneway ............................ Passed 1.21 sec | |
| Start 516: FixTimestep:planeforce | |
| 471/545 Test #516: FixTimestep:planeforce ........................ Passed 1.38 sec | |
| Start 517: FixTimestep:press_berendsen_iso | |
| 472/545 Test #517: FixTimestep:press_berendsen_iso ............... Passed 1.21 sec | |
| Start 518: FixTimestep:python_move_nve | |
| 473/545 Test #518: FixTimestep:python_move_nve ................... Passed 1.44 sec | |
| Start 520: FixTimestep:rattle_bond | |
| 474/545 Test #520: FixTimestep:rattle_bond ....................... Passed 1.34 sec | |
| Start 521: FixTimestep:restrain | |
| 475/545 Test #521: FixTimestep:restrain .......................... Passed 1.21 sec | |
| Start 522: FixTimestep:rigid_group | |
| 476/545 Test #522: FixTimestep:rigid_group ....................... Passed 1.22 sec | |
| Start 523: FixTimestep:rigid_molecule | |
| 477/545 Test #523: FixTimestep:rigid_molecule .................... Passed 1.39 sec | |
| Start 524: FixTimestep:rigid_molecule_tri | |
| 478/545 Test #524: FixTimestep:rigid_molecule_tri ................ Passed 1.22 sec | |
| Start 525: FixTimestep:rigid_nph | |
| 479/545 Test #525: FixTimestep:rigid_nph ......................... Passed 1.22 sec | |
| Start 526: FixTimestep:rigid_nph_small | |
| 480/545 Test #526: FixTimestep:rigid_nph_small ................... Passed 1.38 sec | |
| Start 527: FixTimestep:rigid_npt | |
| 481/545 Test #527: FixTimestep:rigid_npt ......................... Passed 1.22 sec | |
| Start 528: FixTimestep:rigid_npt_small | |
| 482/545 Test #528: FixTimestep:rigid_npt_small ................... Passed 1.21 sec | |
| Start 529: FixTimestep:rigid_nve_group | |
| 483/545 Test #529: FixTimestep:rigid_nve_group ................... Passed 1.39 sec | |
| Start 530: FixTimestep:rigid_nve_molecule | |
| 484/545 Test #530: FixTimestep:rigid_nve_molecule ................ Passed 1.21 sec | |
| Start 531: FixTimestep:rigid_nve_single | |
| 485/545 Test #531: FixTimestep:rigid_nve_single .................. Passed 1.22 sec | |
| Start 532: FixTimestep:rigid_nve_small | |
| 486/545 Test #532: FixTimestep:rigid_nve_small ................... Passed 1.38 sec | |
| Start 533: FixTimestep:rigid_nvt | |
| 487/545 Test #533: FixTimestep:rigid_nvt .........................***Failed 1.22 sec | |
| No PMIx server was reachable, but a PMI1/2 was detected. | |
| If srun is being used to launch application, 16 singletons will be started. | |
| [==========] Running 2 tests from 1 test suite. | |
| [----------] Global test environment set-up. | |
| [----------] 2 tests from FixTimestep | |
| [ RUN ] FixTimestep.plain | |
| [ OK ] FixTimestep.plain (6 ms) | |
| [ RUN ] FixTimestep.omp | |
| /tmp/boegel/LAMMPS/29Aug2024_update2/foss-2024a-kokkos/lammps-stable_29Aug2024_update2/unittest/force-styles/test_main.cpp:97: Failure | |
| Expected: (err) <= (epsilon) | |
| Actual: 1.0180329381098362e-12 vs 9.9999999999999998e-13 | |
| Google Test trace: | |
| /tmp/boegel/LAMMPS/29Aug2024_update2/foss-2024a-kokkos/lammps-stable_29Aug2024_update2/unittest/force-styles/test_main.cpp:90: EXPECT_VELOCITIES: run_vel (normal run, verlet) | |
| [ FAILED ] FixTimestep.omp (9 ms) | |
| [----------] 2 tests from FixTimestep (15 ms total) | |
| [----------] Global test environment tear-down | |
| [==========] 2 tests from 1 test suite ran. (15 ms total) | |
| [ PASSED ] 1 test. | |
| [ FAILED ] 1 test, listed below: | |
| [ FAILED ] FixTimestep.omp | |
| 1 FAILED TEST | |
| Start 534: FixTimestep:rigid_nvt_small | |
| 488/545 Test #534: FixTimestep:rigid_nvt_small ................... Passed 1.21 sec | |
| Start 535: FixTimestep:rigid_single | |
| 489/545 Test #535: FixTimestep:rigid_single ...................... Passed 1.39 sec | |
| Start 536: FixTimestep:rigid_small | |
| 490/545 Test #536: FixTimestep:rigid_small ....................... Passed 1.22 sec | |
| Start 537: FixTimestep:setforce_const | |
| 491/545 Test #537: FixTimestep:setforce_const .................... Passed 1.22 sec | |
| Start 538: FixTimestep:setforce_region | |
| 492/545 Test #538: FixTimestep:setforce_region ................... Passed 1.38 sec | |
| Start 539: FixTimestep:setforce_variable | |
| 493/545 Test #539: FixTimestep:setforce_variable ................. Passed 1.22 sec | |
| Start 541: FixTimestep:shake_bond | |
| 494/545 Test #541: FixTimestep:shake_bond ........................ Passed 1.22 sec | |
| Start 542: FixTimestep:smd_couple | |
| 495/545 Test #542: FixTimestep:smd_couple ........................ Passed 1.39 sec | |
| Start 543: FixTimestep:smd_tether | |
| 496/545 Test #543: FixTimestep:smd_tether ........................ Passed 1.21 sec | |
| Start 544: FixTimestep:spring_chunk | |
| 497/545 Test #544: FixTimestep:spring_chunk ...................... Passed 1.21 sec | |
| Start 545: FixTimestep:spring_couple | |
| 498/545 Test #545: FixTimestep:spring_couple ..................... Passed 1.39 sec | |
| Start 546: FixTimestep:spring_rg | |
| 499/545 Test #546: FixTimestep:spring_rg ......................... Passed 1.21 sec | |
| Start 547: FixTimestep:spring_self | |
| 500/545 Test #547: FixTimestep:spring_self ....................... Passed 1.22 sec | |
| Start 548: FixTimestep:spring_tether | |
| 501/545 Test #548: FixTimestep:spring_tether ..................... Passed 1.38 sec | |
| Start 549: FixTimestep:temp_berendsen | |
| 502/545 Test #549: FixTimestep:temp_berendsen .................... Passed 1.21 sec | |
| Start 550: FixTimestep:temp_csld | |
| 503/545 Test #550: FixTimestep:temp_csld ......................... Passed 1.21 sec | |
| Start 551: FixTimestep:temp_csvr | |
| 504/545 Test #551: FixTimestep:temp_csvr ......................... Passed 1.38 sec | |
| Start 552: FixTimestep:temp_rescale | |
| 505/545 Test #552: FixTimestep:temp_rescale ...................... Passed 1.21 sec | |
| Start 553: FixTimestep:wall_harmonic_const | |
| 506/545 Test #553: FixTimestep:wall_harmonic_const ............... Passed 1.21 sec | |
| Start 554: FixTimestep:wall_lepton_const | |
| 507/545 Test #554: FixTimestep:wall_lepton_const ................. Passed 1.39 sec | |
| Start 555: FixTimestep:wall_lj1043_const | |
| 508/545 Test #555: FixTimestep:wall_lj1043_const ................. Passed 1.21 sec | |
| Start 556: FixTimestep:wall_lj126_const | |
| 509/545 Test #556: FixTimestep:wall_lj126_const .................. Passed 1.21 sec | |
| Start 557: FixTimestep:wall_lj93_const | |
| 510/545 Test #557: FixTimestep:wall_lj93_const ................... Passed 1.38 sec | |
| Start 558: FixTimestep:wall_morse_const | |
| 511/545 Test #558: FixTimestep:wall_morse_const .................. Passed 1.21 sec | |
| Start 559: FixTimestep:wall_region_harmonic_const | |
| 512/545 Test #559: FixTimestep:wall_region_harmonic_const ........ Passed 1.21 sec | |
| Start 560: FixTimestep:wall_table_linear | |
| 513/545 Test #560: FixTimestep:wall_table_linear ................. Passed 1.39 sec | |
| Start 561: FixTimestep:wall_table_spline | |
| 514/545 Test #561: FixTimestep:wall_table_spline ................. Passed 1.22 sec | |
| Start 562: DihedralStyle:charmm | |
| 515/545 Test #562: DihedralStyle:charmm .......................... Passed 1.24 sec | |
| Start 563: DihedralStyle:charmmfsw | |
| 516/545 Test #563: DihedralStyle:charmmfsw ....................... Passed 1.44 sec | |
| Start 564: DihedralStyle:class2 | |
| 517/545 Test #564: DihedralStyle:class2 .......................... Passed 1.24 sec | |
| Start 565: DihedralStyle:cosine_shift_exp | |
| 518/545 Test #565: DihedralStyle:cosine_shift_exp ................ Passed 1.23 sec | |
| Start 566: DihedralStyle:cosine_squared_restricted | |
| 519/545 Test #566: DihedralStyle:cosine_squared_restricted ....... Passed 1.38 sec | |
| Start 567: DihedralStyle:fourier | |
| 520/545 Test #567: DihedralStyle:fourier ......................... Passed 1.22 sec | |
| Start 568: DihedralStyle:harmonic | |
| 521/545 Test #568: DihedralStyle:harmonic ........................ Passed 1.23 sec | |
| Start 569: DihedralStyle:helix | |
| 522/545 Test #569: DihedralStyle:helix ........................... Passed 1.39 sec | |
| Start 570: DihedralStyle:hybrid | |
| 523/545 Test #570: DihedralStyle:hybrid .......................... Passed 1.24 sec | |
| Start 571: DihedralStyle:lepton | |
| 524/545 Test #571: DihedralStyle:lepton .......................... Passed 1.34 sec | |
| Start 572: DihedralStyle:multi_harmonic | |
| 525/545 Test #572: DihedralStyle:multi_harmonic .................. Passed 1.39 sec | |
| Start 573: DihedralStyle:nharmonic | |
| 526/545 Test #573: DihedralStyle:nharmonic ....................... Passed 1.23 sec | |
| Start 574: DihedralStyle:opls | |
| 527/545 Test #574: DihedralStyle:opls ............................ Passed 1.23 sec | |
| Start 576: DihedralStyle:spherical | |
| 528/545 Test #576: DihedralStyle:spherical ....................... Passed 1.39 sec | |
| Start 578: DihedralStyle:table_cut_spline | |
| 529/545 Test #578: DihedralStyle:table_cut_spline ................ Passed 1.26 sec | |
| Start 580: DihedralStyle:table_spline | |
| 530/545 Test #580: DihedralStyle:table_spline .................... Passed 1.28 sec | |
| Start 581: DihedralStyle:zero | |
| 531/545 Test #581: DihedralStyle:zero ............................ Passed 1.39 sec | |
| Start 582: ImproperStyle:class2 | |
| 532/545 Test #582: ImproperStyle:class2 .......................... Passed 1.22 sec | |
| Start 583: ImproperStyle:cossq | |
| 533/545 Test #583: ImproperStyle:cossq ........................... Passed 1.22 sec | |
| Start 584: ImproperStyle:cvff | |
| 534/545 Test #584: ImproperStyle:cvff ............................ Passed 1.39 sec | |
| Start 585: ImproperStyle:distance | |
| 535/545 Test #585: ImproperStyle:distance ........................ Passed 1.22 sec | |
| Start 586: ImproperStyle:distharm | |
| 536/545 Test #586: ImproperStyle:distharm ........................ Passed 1.21 sec | |
| Start 587: ImproperStyle:fourier | |
| 537/545 Test #587: ImproperStyle:fourier ......................... Passed 1.39 sec | |
| Start 588: ImproperStyle:harmonic | |
| 538/545 Test #588: ImproperStyle:harmonic ........................ Passed 1.23 sec | |
| Start 589: ImproperStyle:hybrid | |
| 539/545 Test #589: ImproperStyle:hybrid .......................... Passed 1.23 sec | |
| Start 590: ImproperStyle:inversion_harmonic | |
| 540/545 Test #590: ImproperStyle:inversion_harmonic .............. Passed 1.38 sec | |
| Start 591: ImproperStyle:ring | |
| 541/545 Test #591: ImproperStyle:ring ............................ Passed 1.23 sec | |
| Start 592: ImproperStyle:sqdistharm | |
| 542/545 Test #592: ImproperStyle:sqdistharm ...................... Passed 1.22 sec | |
| Start 593: ImproperStyle:umbrella | |
| 543/545 Test #593: ImproperStyle:umbrella ........................ Passed 1.39 sec | |
| Start 594: ImproperStyle:zero | |
| 544/545 Test #594: ImproperStyle:zero ............................ Passed 1.22 sec | |
| Start 595: TestPairList | |
| 545/545 Test #595: TestPairList .................................. Passed 1.20 sec | |
| 99% tests passed, 3 tests failed out of 545 | |
| Label Time Summary: | |
| generated = 1.38 sec*proc (1 test) | |
| slow = 83.34 sec*proc (44 tests) | |
| Total Test time (real) = 739.20 sec | |
| The following tests FAILED: | |
| 45 - KimCommands (Subprocess aborted) | |
| 478 - FixTimestep:deform_tri (Failed) | |
| 533 - FixTimestep:rigid_nvt (Failed) | |
| Errors while running CTest | |
| == 2026-02-27 15:03:28,314 build_log.py:233 ERROR EasyBuild encountered an error: shell command 'ctest ...' failed in test step for LAMMPS-29Aug2024_update2-foss-2024a-kokkos.eb (at easybuild/framework/easyblock.py:2571 in report_test_failure) | |
| Callstack: | |
| easybuild/framework/easyblock.py:2571 in report_test_failure | |
| easybuild/framework/easyblock.py:3075 in _test_step | |
| easybuild/framework/easyblock.py:4763 in run_step | |
| easybuild/framework/easyblock.py:4922 in run_all_steps | |
| easybuild/framework/easyblock.py:5109 in build_and_install_one | |
| easybuild/main.py:178 in build_and_install_software | |
| easybuild/main.py:612 in process_eb_args | |
| easybuild/main.py:796 in main | |
| easybuild/main.py:844 in main_with_hooks | |
| easybuild/main.py:859 in <module> | |
| == 2026-02-27 15:03:28,315 build_log.py:329 INFO ... (took 12 mins 19 secs) | |
| == 2026-02-27 15:03:28,317 filetools.py:2152 INFO Removing lock /home/boegel/easybuild/Rocky8/neoverse-v1/software/.locks/_home_boegel_easybuild_Rocky8_neoverse-v1_software_LAMMPS_29Aug2024_update2-foss-2024a-kokkos.lock... | |
| == 2026-02-27 15:03:28,323 filetools.py:423 INFO Path /home/boegel/easybuild/Rocky8/neoverse-v1/software/.locks/_home_boegel_easybuild_Rocky8_neoverse-v1_software_LAMMPS_29Aug2024_update2-foss-2024a-kokkos.lock successfully removed. | |
| == 2026-02-27 15:03:28,323 filetools.py:2156 INFO Lock removed: /home/boegel/easybuild/Rocky8/neoverse-v1/software/.locks/_home_boegel_easybuild_Rocky8_neoverse-v1_software_LAMMPS_29Aug2024_update2-foss-2024a-kokkos.lock | |
| == 2026-02-27 15:03:28,323 easyblock.py:390 INFO Closing log for application name LAMMPS version 29Aug2024_update2 |
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