SAPT
Topic | Replies | Views | Activity | |
---|---|---|---|---|
Atomic numbers limit in SAPT?
|
7 | 755 | November 1, 2019 | |
SAPT with ECP for Iodine atom
|
3 | 1865 | August 3, 2019 | |
SAPT (DFT) issues
|
1 | 1111 | July 26, 2019 | |
Bug in the E(30)ind SAPT correction?
|
2 | 612 | July 12, 2019 | |
Higher order SAPT with RI for heavier elements
|
1 | 695 | May 23, 2019 | |
Unusually High Electrostatic Energy for Ionic Systems w/ SAPT2+3?
|
5 | 831 | May 14, 2019 | |
MinAO file extension
|
1 | 679 | May 9, 2019 | |
SAPT(DFT) wB97X-V Error
|
6 | 2035 | May 2, 2019 | |
Interaction between transition metal and waters
|
2 | 665 | May 2, 2019 | |
Is this statement about the SAPT analysis true?
|
11 | 1274 | June 13, 2019 | |
sSAPT Scaling term and F-SAPT
|
3 | 881 | April 12, 2019 | |
F/I SAPT0 problem with three fragments
|
1 | 1680 | April 5, 2019 | |
Open-shell sapt calaculation
|
13 | 1616 | May 26, 2019 |