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Close Stale Close Stale #313: Scheduled
October 13, 2024 00:19 2s main
main
October 13, 2024 00:19 2s
Close Stale Close Stale #312: Scheduled
October 12, 2024 00:17 2s main
main
October 12, 2024 00:17 2s
Close Stale Close Stale #311: Scheduled
October 11, 2024 00:17 3s main
main
October 11, 2024 00:17 3s
Close Stale Close Stale #310: Scheduled
October 10, 2024 00:17 2s main
main
October 10, 2024 00:17 2s
Invalid free when running cpcmx on methane, only for certain solvents Close Stale #309: Issue #1115 labeled by TyBalduf
October 9, 2024 18:28 2s
October 9, 2024 18:28 2s
Close Stale Close Stale #308: Scheduled
October 9, 2024 00:17 3s main
main
October 9, 2024 00:17 3s
Close Stale Close Stale #307: Scheduled
October 8, 2024 00:17 3s main
main
October 8, 2024 00:17 3s
Close Stale Close Stale #306: Scheduled
October 7, 2024 00:18 2s main
main
October 7, 2024 00:18 2s
Close Stale Close Stale #305: Scheduled
October 6, 2024 00:19 2s main
main
October 6, 2024 00:19 2s
GFN-FF does not compute the electrostatic potential Close Stale #304: Issue #1114 labeled by selimsami
October 5, 2024 01:41 1s
October 5, 2024 01:41 1s
Close Stale Close Stale #303: Scheduled
October 5, 2024 00:17 2s main
main
October 5, 2024 00:17 2s
Close Stale Close Stale #302: Scheduled
October 4, 2024 00:17 2s main
main
October 4, 2024 00:17 2s
Close Stale Close Stale #301: Scheduled
October 3, 2024 00:17 2s main
main
October 3, 2024 00:17 2s
cannot use "--gfn 0" option with xtb 6.7.1 Close Stale #300: Issue #1112 labeled by ElioChen
October 2, 2024 16:30 3s
October 2, 2024 16:30 3s
Close Stale Close Stale #299: Scheduled
October 2, 2024 00:17 2s main
main
October 2, 2024 00:17 2s
Parallel hessian calculation with gfnff fails Close Stale #298: Issue #1111 labeled by rasmusslothlundkvist
October 1, 2024 13:29 2s
October 1, 2024 13:29 2s
Difference in geometry (and energy) when using the bash export XTBPATH option. Close Stale #297: Issue #1110 labeled by jonathan-schoeps
October 1, 2024 11:20 3s
October 1, 2024 11:20 3s
Difference in geometry (and energy) when using the bash export XTBPATH option. Close Stale #296: Issue #1110 labeled by jonathan-schoeps
October 1, 2024 11:20 3s
October 1, 2024 11:20 3s
Close Stale Close Stale #295: Scheduled
October 1, 2024 00:19 3s main
main
October 1, 2024 00:19 3s
Close Stale Close Stale #294: Scheduled
September 30, 2024 00:18 2s main
main
September 30, 2024 00:18 2s
Close Stale Close Stale #293: Scheduled
September 29, 2024 00:19 2s main
main
September 29, 2024 00:19 2s
Close Stale Close Stale #292: Scheduled
September 28, 2024 00:17 2s main
main
September 28, 2024 00:17 2s
xTB + GCC 14.1: multiple test fails Close Stale #291: Issue #1109 labeled by foxtran
September 27, 2024 09:10 3s
September 27, 2024 09:10 3s
Close Stale Close Stale #290: Scheduled
September 27, 2024 00:17 3s main
main
September 27, 2024 00:17 3s
Close Stale Close Stale #289: Scheduled
September 26, 2024 00:16 2s main
main
September 26, 2024 00:16 2s