<p>Hello ;</p><p>Since deuterium and hydrogen have different masses but have the same symbols, can you help with how to write them in the input?<br>.<br>.<br>   <br>&KIND H (hydrogen)<br>      BASIS_SET DZVP-MOLOPT-SR-GTH<br>      MASS 1<br>      POTENTIAL GTH-BLYP-q1<br>    &END KIND<br>&KIND H (deuterium)??????<br>      MASS 2.0141<br>      BASIS_SET DZVP-MOLOPT-SR-GTH<br>      POTENTIAL GTH-BLYP-q4<br>    &END KIND<br>.<br>.<br>.<br>.<br>Best Regards</p>

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