Subject / Started by | Replies / Views | Last post | ||
---|---|---|---|---|
Density plots from DSCF
Started by cwoods7 |
3 Replies
2325 Views |
March 13, 2024, 10:02:35 PM by uwe |
||
point charge changed problem
Started by chenjinfeng |
1 Replies
2684 Views |
April 01, 2021, 03:08:47 PM by uwe |
||
point charges in a HF-3c calculation
Started by makochman1 |
0 Replies
2777 Views |
July 27, 2021, 04:46:42 PM by makochman1 |
||
DSCF No Exchange Energy
Started by cwoods7 |
3 Replies
2790 Views |
February 17, 2024, 10:35:04 AM by chris.hol |
||
Triplet scf converges to singlet
Started by akn123 |
1 Replies
2934 Views |
March 26, 2020, 08:28:19 AM by antti_karttunen |
||
2 Replies
3124 Views |
July 01, 2020, 08:18:01 PM by farmaceut |
|||
0 Replies
3175 Views |
June 16, 2023, 04:30:39 PM by rusakov |
|||
1 Replies
3196 Views |
December 23, 2023, 11:28:27 AM by yannickf |
|||
1 Replies
3276 Views |
July 10, 2023, 07:22:01 PM by uwe |
|||
2 Replies
3321 Views |
September 27, 2023, 12:41:52 AM by jcardol |
|||
1 Replies
3365 Views |
December 23, 2023, 11:36:15 AM by yannickf |
|||
prinitng fock, density and overlap matrices
Started by KrisR |
1 Replies
3516 Views |
June 30, 2019, 08:34:23 PM by uwe |
||
Problem with mpsts-noa2 in aoforce
Started by JakubV |
2 Replies
3556 Views |
February 18, 2023, 02:10:36 AM by JakubV |
||
1 Replies
3755 Views |
July 10, 2019, 08:45:11 PM by uwe |
|||
5 Replies
3831 Views |
April 12, 2024, 01:12:46 AM by yannickf |
|||
DFT-D4 energy for charged systems
Started by cneiss |
3 Replies
3944 Views |
March 02, 2022, 10:45:32 AM by uwe |
||
0 Replies
3952 Views |
December 15, 2021, 12:19:56 AM by dsahsah |
|||
RIDFT problem
Started by golden |
3 Replies
3963 Views |
August 17, 2020, 07:13:44 PM by golden |
||
D4 - Edisp /kcal,au: NaN NaN
Started by martijn |
3 Replies
4037 Views |
May 02, 2022, 08:58:50 PM by uwe |
||
2 Replies
4161 Views |
March 08, 2022, 05:40:47 AM by prasanta13 |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic