| Subject / Started by | Replies / Views | Last post ![]() |
||
|---|---|---|---|---|
|
|
2 Replies
75171 Views |
by Amin |
|
|
|
0 Replies
18320 Views |
by Amin |
|
|
|
Plish in gradient step?
Started by avsfan92 |
2 Replies
33724 Views |
by avsfan92 |
|
|
Point Multipole Embedding for Gradients
Started by aaa16797 |
0 Replies
30007 Views |
by aaa16797 |
|
|
DFT-D4 dispersion for heavy elements
Started by arturosauza |
6 Replies
70170 Views |
by arturosauza |
|
|
oribital swap in conventional DFT
Started by acd81 |
0 Replies
44190 Views |
by acd81 |
|
|
No HF exchange in 2c-rdgrad(GA)
Started by januszc |
2 Replies
55057 Views |
by januszc |
|
|
1 Replies
48588 Views |
by chris.hol |
|
|
|
1 Replies
51194 Views |
by uwe |
|
|
|
2 Replies
64460 Views |
by tingst2 |
|
|
|
R2SCAN-3C Functionals
Started by johanneswerner |
1 Replies
50514 Views |
by uwe |
|
|
D4 - Edisp /kcal,au: NaN NaN
Started by martijn |
9 Replies
124700 Views |
by rusakov |
|
|
undocumented option for DFT-NL
Started by acd81 |
7 Replies
95818 Views |
by acd81 |
|
|
3 Replies
68013 Views |
by yannickf |
|
|
|
two-electron integrals
Started by Dawood234 |
0 Replies
50661 Views |
by Dawood234 |
|
|
5 Replies
82400 Views |
by yannickf |
|
|
|
Density plots from DSCF
Started by cwoods7 |
3 Replies
64497 Views |
by uwe |
|
|
DSCF No Exchange Energy
Started by cwoods7 |
3 Replies
80391 Views |
by chris.hol |
|
|
1 Replies
65535 Views |
by yannickf |
|
|
|
2 Replies
56958 Views |
by jcardol |
|
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic