Version (1.3.4.1)

andrewsalij · Jan 3, 2024 · 447f139 · 447f139
commit 447f139
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diff --git a/.idea/.gitignore b/.idea/.gitignore
diff --git a/.idea/ChiralPolACD.iml b/.idea/ChiralPolACD.iml
diff --git a/.idea/inspectionProfiles/profiles_settings.xml b/.idea/inspectionProfiles/profiles_settings.xml
diff --git a/.idea/misc.xml b/.idea/misc.xml
diff --git a/.idea/modules.xml b/.idea/modules.xml
diff --git a/.idea/vcs.xml b/.idea/vcs.xml
diff --git a/DFT/wb97xd_opt_cis.xyz b/DFT/wb97xd_opt_cis.xyz
@@ -0,0 +1,56 @@
+54
+Oligothiophene geometry optimized under wB97X-D/6-311G(d,p), cis configuration
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diff --git a/DFT/wb97xd_opt_trans.xyz b/DFT/wb97xd_opt_trans.xyz
@@ -0,0 +1,56 @@
+54
+Oligothiophene geometry optimized under wB97X-D/6-311G(d,p), trans configuration
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