|
Difference between two types of SAPT
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|
0
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762
|
February 26, 2019
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|
A detailed article on SAPT is requested
|
|
0
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801
|
February 23, 2019
|
|
About the concept of energy decomposition
|
|
12
|
1370
|
April 22, 2019
|
|
About user-defined basis set in PSI4
|
|
10
|
2452
|
April 21, 2019
|
|
Plugin with TargetLAPACK cannot find -lsvml during linking
|
|
2
|
966
|
January 30, 2019
|
|
Four-center one-electron integral
|
|
2
|
1175
|
January 25, 2019
|
|
Issue after psi4 compilation psi4 1.3 dev
|
|
6
|
928
|
March 21, 2019
|
|
Installation problem with psi dmrg
|
|
9
|
3599
|
December 27, 2018
|
|
Duplicate symbol when linking core.so
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|
2
|
1582
|
November 14, 2018
|
|
Building with high AM
|
|
21
|
3905
|
July 24, 2018
|
|
Build high angular moment(>7) psi4 with conda error
|
|
1
|
879
|
July 7, 2018
|
|
Build failed at libxc_external
|
|
3
|
1677
|
June 29, 2018
|
|
Installation query
|
|
1
|
937
|
June 28, 2018
|
|
Running psi4 as root
|
|
8
|
1637
|
June 19, 2018
|
|
Problem with building Psi4 of March 4, 2018
|
|
1
|
1019
|
March 7, 2018
|
|
Error in building psi4 via conda on Ubuntu
|
|
3
|
1159
|
February 26, 2018
|
|
Using a prebuilt psi4 static binary elsewhere
|
|
2
|
975
|
February 15, 2018
|
|
Segmentation faults + symmetry issues
|
|
7
|
1824
|
February 15, 2018
|
|
Psi4 runtime Python failure
|
|
2
|
1184
|
February 1, 2018
|
|
Failure in building Libint
|
|
3
|
2027
|
December 14, 2017
|
|
PSI4 Installation with LibXC Support
|
|
5
|
1446
|
December 14, 2017
|
|
"Segmentation fault (core dumped)" error
|
|
3
|
3633
|
December 6, 2017
|
|
Problem with building psi4 on mac
|
|
2
|
1124
|
December 6, 2017
|
|
Single test failure from full ctest suite (scf-coverage)
|
|
6
|
1717
|
September 30, 2017
|
|
Conda installer OpenMP Mac
|
|
3
|
1898
|
September 14, 2017
|
|
PSI4 on CentOS cluster
|
|
9
|
4470
|
July 19, 2017
|
|
Creating a plugin for a SCF calculation from the DePrince tutorials
|
|
7
|
1744
|
July 19, 2017
|
|
Error during the make step 'libderiv_library'
|
|
6
|
2593
|
May 16, 2017
|
|
Anyone tried MKL MIC automatic offloading?
|
|
1
|
1098
|
May 12, 2017
|
|
Report conda update psi4 oddities here
|
|
6
|
5178
|
April 25, 2017
|