Merge pull request #350 from merzlab/master

Master merge
merzlab · Mar 20, 2024 · 9109dc4 · 9109dc4
2 parents d202745 + 2257ba8
commit 9109dc4
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diff --git a/CMake-Options.md b/CMake-Options.md
@@ -26,5 +26,5 @@ These options allow you do adjust this behavior.
 By default QUICK will only build the serial version.  This can be changed with these options:
 - `-DMPI=TRUE`: Also build MPI versions of all programs.
 - `-DCUDA=TRUE`: Also build CUDA versions of all programs.  If both MPI and CUDA are active at the same time, CUDA MPI versions will additionally be built.
-- `-DQUICK_USER_ARCH=<kepler|maxwell|pascal|volta|turing|ampere>`: Build CUDA code only for the given architecture.  If not provided, quick will compile for all supported architectures in your CUDA version.
+- `-DQUICK_USER_ARCH=<kepler|maxwell|pascal|volta|turing|ampere|adalovelace>`: Build CUDA code only for the given architecture.  If not provided, quick will compile for all supported architectures in your CUDA version.
 - `-DQUICK_VERBOSE_PTXAS=TRUE`: Pass -v flag to ptxas to dump details about compiled functions in CUDA code.
diff --git a/basis/6-311G2DF2PD.BAS b/basis/6-311G2DF2PD.BAS
@@ -8,7 +8,7 @@
 !        Role: orbital
 !     Version: 0  (Data from the Original Basis Set Exchange)
 !----------------------------------------------------------------------
-! Available elements: H Li Be B C N O F Ne K Ca
+! Available elements: H He Li Be B C N O F Ne K Ca
 !----------------------------------------------------------------------