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Another bug with Qindex in merging 2 sparse fields from the recent mo… Regression Test #647: Commit f49ed07 pushed by Trovemaster
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develop
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Found a bug in the sparse-compact subroutine with Qindex using the FL… Regression Test #646: Commit 6be9033 pushed by Trovemaster
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Introduced different expansion geometry for external into basic funct… Regression Test #645: Commit 42f4487 pushed by Trovemaster
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develop
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Updated the error message in read_fields to be consistent with the fi… Regression Test #644: Commit f5bfe2b pushed by Trovemaster
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develop
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found and fixed a very important bug in me_bnd legendre_k1 with the m… Regression Test #643: Commit c5d4da5 pushed by Trovemaster
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develop
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deactivate propack in diag.f90 and fix the array index +1 problem in… Regression Test #642: Commit 17fb169 pushed by Trovemaster
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develop
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Remove stop from Momenta-linear part cannot be singular squared, the… Regression Test #641: Commit 110dbea pushed by Trovemaster
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Changes due to the new kinetic operator for HOPO Regression Test #640: Commit 41d4f32 pushed by Trovemaster
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develop
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Updated the basic function pot case by fixing problems in the basis s… Regression Test #639: Commit da1d2d1 pushed by Trovemaster
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Using inverse masses as mode 0 basis functions in KEO with a key word… Regression Test #638: Commit ac12a48 pushed by Trovemaster
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Trying to make sin*cosx^n work for the potential .chk but it is diffi… Regression Test #637: Commit a6d1e55 pushed by Trovemaster
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New coordinate type for HOPO PEF COS(A0)-COS(A))*SINA Regression Test #636: Commit 7eb56ae pushed by Trovemaster
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develop
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New KEO for HOPO: add _ark; Symmetry for HOPO for the CIS case is dif… Regression Test #635: Commit 806dbd4 pushed by Trovemaster
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New singular (5 mode) KEO for HOPO added which now hopefully treats t… Regression Test #634: Commit 57d0d1d pushed by Trovemaster
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New KEO for XY2 was added with all necessary components Regression Test #633: Commit 28e65f4 pushed by Trovemaster
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corrected how external.chk with modes is read: to keep the iterm valu… Regression Test #632: Commit 13a2252 pushed by Trovemaster
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XY2 KEO updated and tested for H2S. Seems working Regression Test #631: Commit 71e40b0 pushed by Trovemaster
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Added with-modes to control to allow for correct processing this case Regression Test #630: Commit 762244c pushed by Trovemaster
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Implementation of rigid XYZ case for EKE, compact and poten and exter… Regression Test #629: Commit 6765055 pushed by Trovemaster
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New type -c(x0)-cos(x) to be used with expansion of PEF in terms of c… Regression Test #628: Commit a835786 pushed by Trovemaster
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mulimode option is added to select expansion modes using a multimode … Regression Test #627: Commit 320d7e7 pushed by Trovemaster
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Bug fixed in treating negative powers in KEO; new type mol_zxy3 added… Regression Test #626: Commit 1557437 pushed by Trovemaster
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Improving handling non-existing expansion matrix elements Regression Test #625: Commit 321fc79 pushed by Trovemaster
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New numerical integration of harmonic type introduced Regression Test #624: Commit 51d1328 pushed by Trovemaster
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new pot_type XY2 added Regression Test #623: Commit 479da07 pushed by Trovemaster
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