Monatshefte f,volume 139,issue 4  (04-2014)

Period of time： 2014年4期

Publisher： Springer Publishing Company

Founded in： 1880

Total resources： 43

ISSN： 0026-9247

Subject： O Mathematical Sciences and Chemical

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Monatshefte f,volume 139,issue 4

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Computational Chemistry techniques: covering orders of magnitude in space, time, and accuracy

By Sax Alexander F. in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 299-308

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Accurate thermochemistry from quantum chemical calculations?

By Fabian Walter M. F. in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 309-318

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Quantum chemical calculations of electronically excited states: formamide, its protonated form and alkali cation complexes as case studies

By Antol Ivana in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 319-328

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Kolbe-Schmitt reaction of sodium 2-naphthoxide

By Marković Zoran in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 329-335

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Ruthenium-mediated C-C coupling reactions of alkynes - mechanistic investigations based on DFT calculations

By Kirchner Karl in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 337-348

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Theoretical investigation (DFT and MP 2) of the intermolecular proton transfer in the supersystems uracil-(H 2 O) n and uracil-(CH 3 OH) n ( n = 1, 2)

By Delchev Vassil B. in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 349-362

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Density functional calculations on cyclodextrins

By Karpfen Alfred in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 363-371

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Adsorption and reaction of organic molecules on solid surfaces - ab-initio density functional investigations

By Hafner Jürgen in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 373-387

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First-principles approach to the understanding of π-conjugated organic semiconductors

By Puschnig Peter in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 389-399

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Hydrophobic moments as physicochemical descriptors in structure-activity relationship studies of P-glycoprotein inhibitors

By König Gerhard in (2008)

Monatshefte f,volume 139,issue 4 , Vol. 139, Iss. 4, 2008-04 , pp. 401-405

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