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Re^2: How to find out, some basis is spherical or cartesian?

Vyacheslav
kreme_vg@chemy.kolasc.net.ru


How I recognize, whether the d5 option is ignored or not?
And also - how Firefly finds out when to ignore this option and when no?

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On Mon Jan 18 '10 6:43pm, sanya wrote
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>Just eneter d5=.t. If the basis is spherical, this option will be simply ignored.


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