quack/mol/hydrogen_chloride.xyz

mirror of https://github.com/pfloos/quack synced 2024-12-23 04:43:53 +01:00
2

Cl   0.00000000            0.00000000           -0.01317536
H    0.00000000            0.00000000            1.26199843
xyz files 2020-10-12 14:30:00 +02:00			`2`
safer but slower orthogonalization in pp-RPA 2021-10-21 22:40:20 +02:00
xyz files 2020-10-12 14:30:00 +02:00			`Cl 0.00000000 0.00000000 -0.01317536`
safer but slower orthogonalization in pp-RPA 2021-10-21 22:40:20 +02:00			`H 0.00000000 0.00000000 1.26199843`