... PyMol is a powerful drawing instrument and here we show how to plot Fukui function with PyMOL after two calculation steps with FireFly (PC-GAMESS). ... Because total HOMO orbital have two electrons and should be divided by two (see equations at the beginning). 1 комментарий " Building and plotting Fukui function with FireFly and PyMol " . Quantum chemistry information page ERG Research Group: Лаборатория теоретической биофизики написал (Май 20th, 2015 12:43 пп) . ... 2014 ERG Research Group . ...
download:rn-061106 ]] . CompHEP . Trace: rn-061106 . Since gcc-4 spreads through more and more the Linux community we prepared a special version of comphep-4.4p3 for the compiler. The code itself is the same with the only minor exeption in a FORTRAN part (file FeynHiggsFastCodes.f), where the COMPLEX type description has been replaced with COMPLEX*16 (Requirement of gfortran). ... gcc (version 4) with the new GNU FORTRAN 95 compiler gfortran, which can also compile FORTRAN 77 code. ...
CURRICULUM VITAE Nataliya V. Roznyatovskaya, Ph.D. Moscow State University Chemical Faculty, Department of Electrochemistry Vorob'evy Gory, MSU, 119992 Moscow Russia Tel: +7(495)-939-25-70, Fax: +7(495)-932-88-46 E-mail: natasha@elch.chem. msu.ru www. elch.chem. msu.ru/~natasha/ Personal: Born: December 27, 1979 (Moscow) Citizenship: Russian Family state: unmarried Education: 2002 Diploma in Chemistry from Moscow State University, Chemical Faculty, Department of Chemical Enzymology. ...
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Ссылки http://www.elch.chem.msu.ru/~natasha/CV_Roznyatovskaya_pdf.pdf -- 24.8 Кб -- 22.03.2006
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Ссылки http://electr003.chem.msu.ru/~natasha/CV_Roznyatovskaya_pdf.pdf -- 24.8 Кб -- 22.03.2006 Похожие документы
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