G98: ONIOM and Amber on TM systems

[val -x- at -x- nmr-v.ioc.ac.ru]

Hi!
 

 I am trying to optimize platinum organometallic complex
 at the ONIOM(HF/lanl2dz:Amber) level. Where platinum
 atom and the neighbors are defined as the high layer (HF)
 and the rest system as low layer (MM).
 

 Unfortunately, the program stops with the error message:
 

 > Missing atomic parameters for atom     1 IAtTyp=           0
 

 where atom 1 is platinum, which is defined as high layer
 and should not be treated with MM.
 

 Is it a known thing in G98? What the solution possible?
 

 Can anybody send me an example of input file of oniom/amber
 application on transition metal containing system?
 

 thanks! will be summarized.
 

 best regards, Valentine.
 

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                                             ,         ,      ,   ,
 Valentine P. Ananikov                        |\\\\ ////|     /////|
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