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eplf/test/QCIO_File/geometry
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Anthony Scemama 5069a720a0 Reduce memory and correct bug with qcio
2009-05-18 15:00:54 +02:00
..
.exists Integral over contracted basis functions OK. 2009-05-11 23:43:45 +02:00
atomic_number.gz Reduce memory and correct bug with qcio 2009-05-18 15:00:54 +02:00
charge.gz Reduce memory and correct bug with qcio 2009-05-18 15:00:54 +02:00
coord.gz Reduce memory and correct bug with qcio 2009-05-18 15:00:54 +02:00
label.gz Reduce memory and correct bug with qcio 2009-05-18 15:00:54 +02:00
nuc_energy Integral over contracted basis functions OK. 2009-05-11 23:43:45 +02:00
num_atom Integral over contracted basis functions OK. 2009-05-11 23:43:45 +02:00