CCL: SCF convergence problem with M06L functional in Gaussian 09



Dear Bulumoni,
 Your keywords (scf(xqc, maxcycle=500, novaracc, noincfock)) also helped me
 for my SCF convergence problem.
 Thank you very much
 Doç. Dr. Gül ÖZPINAR
 Çanakkale Onsekiz Mart Üniversitesi
 Mühendislik Fakültesi
 Kimya Mühendisliği Bölümü
 Terzioğlu Kampüsü 17100, Çanakkale, Türkiye.
 Assoc. Prof. Dr. Gül ÖZPINAR
 Canakkale Onsekiz Mart University
 Faculty of Engineering
 Department of Chemical Engineering
 Terzioglu Campus, 17100, Çanakkale, Turkey.
 Fax: (+)90(286)2180541
 Phone: (+)90(286)2180018 - 2261
 On Mon, Feb 29, 2016 at 7:57 AM, Bulumoni Kalita bulumoni-$-dibru.ac.in <
 owner-chemistry]|[ccl.net> wrote:
 >
 > Sent to CCL by: "Bulumoni  Kalita" [bulumoni-x-dibru.ac.in]
 > Dear users,
 >      Thank you very much for your fruitful discussion.  Ultimately, I
 > could solve the problem as follows:
 >
 > %chk=Pd4_3.chk
 > #p opt(maxcycle=500) scf(xqc, maxcycle=500, novaracc, noincfock)
 > um06l/genecp nosym
 >
 > Pd4
 >
 > 0 1
 > Pd                 1.55076100   -0.20840900   -0.52663500
 > Pd                -0.96047300   -1.23708300   -0.51996300
 > Pd                 0.00639500   -0.00412900    1.56159200
 > Pd                -0.59668400    1.44962100   -0.51499300
 >
 > Pd 0
 > LANL2DZ
 > ****
 >
 > Pd 0
 > LANL2DZ
 >
 >
 >
 > -= This is automatically added to each message by the mailing script =->
 >
 >