ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Feb29-2024 20:02:58 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 1434.362999999999 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20:02:54 Nodes: 1 Procs: 1 Feb29-2024 20:02:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Feb29-2024 20:02:56 Nodes: 1 Procs: 1 Feb29-2024 20:02:56 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Feb29-2024 20:02:57 Nodes: 1 Procs: 1 Feb29-2024 20:02:57 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Feb29-2024 20:02:58 Nodes: 1 Procs: 28 *** (NO TITLE) *** 0 -12.23843074 -12.30729306 -12.31218626 -12.31419674 -12.31452443 -12.31489800 -12.31503576 -12.31510141 -12.31512881 -12.31517762 -12.31520085 -12.31524925 -12.31528286 -12.31532993 -12.31536002 -12.31537855 -12.31538407 GEOMETRY CONVERGED