Working on Jastrow

2024-11-03 20:54:09 +01:00 · 2023-03-30 12:34:17 +02:00 · 2023-03-30 12:34:17 +02:00 · fdf6b905bb
commit fdf6b905bb
parent 2ecfc55dbc
2 changed files with 1857 additions and 1886 deletions
--- a/org/qmckl_distance.org
+++ b/org/qmckl_distance.org
@ -875,7 +875,7 @@ end function test_qmckl_dist
   pairs of points in two sets, one point within each set:

   \[
-   C_{ij} = \left( 1 - \exp \left(-\kappa C_{ij} \right) \right)/\kappa
+   C_{ij} = \frac{ 1 - e^{-\kappa r_{ij}}}{\kappa}
   \]

   If the input array is normal (~'N'~), the xyz coordinates are in
--- a/org/qmckl_jastrow.org
+++ b/org/qmckl_jastrow.org