Commit 9ed6994c authored by Andrew Wildman's avatar Andrew Wildman
Browse files

Merge branch 'v0.3.3-rc' into 'master'

Updated version and log for v0.3.3 release

See merge request chronusq/chronusq_dev!61
parents c647cffa e3ad1d22
Pipeline #944 passed with stage
in 74 minutes and 52 seconds
......@@ -9,6 +9,19 @@
- 2020-07-17 0.3.3 (BETA)
- Support multiplicities up to element Es for SAD guess
- Fix incorrect multiplicities for elements S, P, and Mn in SAD guess
- Restructure SingleSlater class to have CoreHBuilder and FockBuilder objects
- Fix incorrect reference data for X2C RT unit tests
- Fix uncontracted basis by removing duplicate primitives
- Allow arbitrary indentation now allowed in input file
- Fix mixed GEMM call between double and dcomplex types
- Fix input basis case sensitivity when parsing element labels
- Fix simultaneous file read failure from GPLHR_MPI tests
- Fix include guards
- Bump OpenBLAS -> v0.3.9
- 2020-04-25 0.3.2 (BETA)
- Add ability to read user specified basis from input file or path to file
- Add B3PW91 functional
......@@ -24,7 +24,7 @@ cmake_minimum_required(VERSION 3.11 FATAL_ERROR)
project(ChronusQ CXX C Fortran)
set(ChronusQ_VERSION_MAJOR 0)
set(ChronusQ_VERSION_MINOR 3)
set(ChronusQ_VERSION_PATCH 2)
set(ChronusQ_VERSION_PATCH 3)
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