PC GAMESS/Firefly TIME DEPENDENT DENSITY FUNCTIONAL THEORY MODULE $TDDFT group required when CITYP=TDDFT (note that CITYP=TDDFT requires DFTTYP to be set in $CONTRL) Current implementation allows the use of only R-DFT references, but can pick up both singlet and triplet excited states. ... The default for n is the number of chemical core orbitals. ... ALTER - flag to modify internal logic of Davidson diagonalization code to use dynamic number of trial vectors. ... PC GAMESS/Firefly' NBO code . ...
. Jump to: navigation , search . You must log in to view other pages. Retrieved from " http://algcourse.cs.msu.su/teachwiki/index.php/Main_Page " . Page . Discussion . View source . History . Log in . Новости, главное . Страница курса . Сдача заданий . 1-й семестр 2015 г. Материалы по системе ejudge . Планы прошлых лет . Участники . Recent changes . What links here . Related changes . Special pages . Printable version . Privacy policy . About MediaWiki . Disclaimers
... Energy-linked binding of Pi is required for continuous steady-state proton-translocating ATP hydrolysis catalyzed by F0.F1 ATP synthase. ... The data are interpreted to suggest that coupled and uncoupled ATP hydrolysis catalyzed by Fo.F1 ATP synthases proceeds via different intermediates. ... Pi dissociates before ADP during uncoupled ATP hydrolysis, leaving the E.ADP intermediate which is transformed into the inactive ADP(Mg2+)-inhibited form of the enzyme (latent ATPase). ...
... THE PARALLELIZATION OF COMPUTATIONAL ALGORITHMS IN LARGE PHYSICS PROBLEMS ON MULTIPROCESSOR COMPUTER SYSTEM CONTAINING THOUSAND AND MORE OF PROCESSOR ELEMENTS REQUIRES SPECIAL TOOLS. ... THE GENETIC ALGORITHM CAN BE CHARACTERIZED BY THE FOLLOWING PARAMETERS: - coding strategy, - population size, - initialisation strategy, - selection technique, - crossover mechanism, - mutation mechanism, - strategy for offspring inclusion. ... The results are presented on the following figure. ...
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Ссылки http://acat02.sinp.msu.ru/presentations/nikitin/posterACAT2002.doc -- 178.5 Кб -- 29.07.2002 Похожие документы
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... Online Services | ... Construct your query and output by sequental openings of needed fields. One output field must be selected (not be blank) at least. ... Query parameters: . Select for output . ... Energy (keV) . ... Y D H M S MS US NS PS FS AS EV KEV MEV or Stable . ... Energy of the ?-ray (keV) . ... Energy parameters of nucleus (B , Alpha energy, N, P separation energy) . ... Neutron separation energy (keV) . Proton separation energy (keV) . ... Excited energy(keV) . ...
Using stand-alone SDPfox . ... To add a new specificity group, type in the group name and press "Add" . To change composition of specificity groups, select two groups: first, from which to remove sequences, and second, to which to add sequences. ... For a constructed grouping, it is possible to run SDPgroup, re-randomize grouping or move sequences according to the best weights (see algorithm) under the link 'SDPgroup'. ... These sequences are likely to be re-grouped after SDPgroup is performed. ...
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Problem 1. ... To solve the problem, we should express the ratio of rate constants at temperatures T 2 and T 1 using the Arrhenius equation. ... X - CH 3 , Y - COOH. ... 0.084 / 56 = 0.03 mol. ... Cu) = 4.8 / 64 = 0.075 mol; (NaOH) = 100 . ... 0.15 . ... 2NO 2 . ... I 2 ) = 0.0375 + 0.1125 = 0.15 mol, m (I 2 ) = 0.15 . ... Example problems in chemistry for the entrance exams: . Preliminary round . ... Special Program developed for chemistry entrance examinations in Moscow State University. ...
... METHOD . ... public interface IndexMap . ... The int [] transform(int [] output, int [] input) does this. ... The transformation of values in the input array is obtained by calling int [] getTransformed(int [] output) . ... int[] . ... input - int array domain reference member. public int[] getTransformed (int[] output) . ... public int[] transform (int[] output, int[] input) . ... lengths - int array representing the shape on the forward transform output. public int[] getLengths (int[] output) . ...
BIRD SPECIES DATABASE . of the Arctic Birds Breeding Conditions Survey . ... Queries . View list of species . ... Get list of species, for which data are available by pushing "Query" button below "View list of species" invitation. Latin name of a species can be copied from the list to the "Species name" field or typed-in there (but exactly as it appears in the species list). ... Query results will be tabulated in the window below the map, and can be browsed through or copied. ...
astro-ph/0608407 Прямое эмпирическое доказательство существования темной материи (A direct empirical proof of the existence of dark matter) . Authors: Douglas Clowe et al. astro-ph/0608087 Передача энергии при планетных пролетах (The Energy Transfer Process in Planetary Flybys) . Authors: John D. Anderson, James K. Campbell, Michael Martin Nieto . astro-ph/0608257 Гамма-всплеск GRB060614 требует новый механизм взрыва (The gamma-ray burst GRB060614 requires a novel explosive process) . ...
... Number of required sensors is 10000 4 The part of ANTARES collaboration (http://antares.in2p3.fr/Collaboration/index.html) 5 The some direction of MSU group activity in the project · Bioluminescence cut · Quality cuts · SN search 6 Bioluminescence cut We have collected distributions of hit counts for each PMT during one K40 run (~45min) Usually these distributions consist of 2 parts Poissonian (due to K40 and plankton ... Conclusion Bioluminescence cut was done. ...
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Ссылки http://antares.sinp.msu.ru/docs/Shirokov%20-%20The%20first%20results%20of%20MSU%20groups%20in%20ANTARES%20project.pdf -- 643.2 Кб -- 16.12.2013 Похожие документы
... The memory retrieval process of number problems with external noise is studied with the use of the Bonhoeffer-van der Pol oscillator model. Three cell assembly responses are simulated, coding one true number and two neighboring erroneous. The time of a correct response, Tc , was averaged over statistical assemblies of numerous trials. ... At the same time, the probability for the second oscillator to be excited first increases, i.e., the relative number of the correct responses decreases. ...
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Ссылки http://brain.bio.msu.ru/papers/Kaplan_Landa_Zhukovskaya_2003_BiolCyb_MemorySpeed.pdf -- 255.8 Кб -- 08.01.2004 Похожие документы
... Molecular Mechanics Calculations of beta-Diketonate, Aqua, And Aqua-beta-Diketonate Complexes of Lanthanide Ions Using Gillespie-Kepert Model . ... Abstract - A version of molecular mechanics based on the Gillespie-Kepert model of coordination bonds "repulsion" is applied to lanthanide complexes. ... For the aqua complexes, typical root-mean-square deviation (calculated vs. ...
EMBEDDING FORMULAE FOR DIFFRACTION BY NON-PARALLEL SLITS by E. A. Skelton1 , R. V. Craster1 A. V. Shanin2 ( 1 Department of Mathematics, Imperial ... (Acoustics Division), Moscow State University, 119992, Leninskie Gory, Moscow, Russia ) [Received Octob er 24, 2007] Summary Emb edding formulae for diffraction theory encode the diffraction coefficients for some given wave incidence on a scatterer in terms of the ... The directivity of these edge Green's ^ functions are denoted by Dj (; al± ). ...
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Ссылки http://acoustics.phys.msu.su/teachers/shanin_files/~shanin/papers/embed08.pdf -- 355.8 Кб -- 14.03.2011
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Ссылки http://acoustics.phys.msu.ru/teachers/shanin_files/~shanin/papers/embed08.pdf -- 355.8 Кб -- 14.03.2011 Похожие документы