Pascal and Francis Bibliographic Databases


Search results

Your search

kw.\*:("Estructura electrónica")


A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Document Type [dt]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Publication Year[py]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Discipline (document) [di]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV


A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Author Country

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV


A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Results 1 to 25 of 16072

  • Page / 643

Selection :

  • and

Computational complexity in electronic structureWHITFIELD, James Daniel; LOVED, Peter John; ASPURU-GUZIK, Alán et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 2, pp 397-411, issn 1463-9076, 15 p.Article

Electronic structure, adsorption geometry, and photoswitchability of azobenzene layers adsorbed on layered crystalsLUDWIG, Eric; STRUNSKUS, Thomas; HELLMANN, Stefan et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 46, pp 20272-20280, issn 1463-9076, 9 p.Article

Functionalized corannulene cations: a detailed theoretical surveyROGACHEV, Andrey Yu; FILATOV, Alexander S; ZABULA, Alexander V et al.PCCP. Physical chemistry chemical physics (Print). 2012, Vol 14, Num 10, pp 3554-3567, issn 1463-9076, 14 p.Article

Electronic structure and ferromagnetic effect in Ni2MnGa alloyWAN, J. F; LEI, X. L; CHEN, S. P et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2005, Vol 36, Num 1, pp 262-267, issn 1073-5623, 6 p.Article

The first-principles calculations of the electronic structure of the surfaces of pure metals and layers adsorbed on their surfacesCHULKOV, E. V; SILKIN, V. M; LIPNITSKII, A. G et al.Electrochimica acta. 1989, Vol 34, Num 1, pp 19-27, issn 0013-4686Article

Iron at earth-core conditions : A novel method of advanced materials processingMODAK, P; VERMA, A. K; RAO, R. S et al.Journal of materials science. 2006, Vol 41, Num 5, pp 1523-1527, issn 0022-2461, 5 p.Conference Paper

Heteroaromaticity approached by charge density investigations and electronic structure calculationsHEY, Jakob; LEUSSER, Dirk; KRATZERT, Daniel et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 47, pp 20600-20610, issn 1463-9076, 11 p.Article

Photoelectron spectroscopy of polyconjugated polymer surfaces and interfacesSALANECK, W. R.Reports on Progress in Physics (Print). 1991, Vol 54, Num 9, pp 1215-1249, issn 0034-4885Article

Propriétés optiques et structure électronique des sesquioxydes et sesquisulfures de lanthanidesZHUZE, V. P; SHELYKH, A. I.Fizika i tehnika poluprovodnikov. 1989, Vol 23, Num 3, pp 393-415, issn 0015-3222Article

On the electronic band structure of periodic β-pleated sheet polypeptides in the presence of water and ionsLIEGENER, C.-M; OTTO, P; RUNSHENG CHEN et al.Theoretica chimica acta. 1988, Vol 73, Num 5-6, pp 449-458, issn 0040-5744Article

Investigation on poly(vinylene sulphide): ab initio energy band structure, use of effective core potentials, lattice sum truncationOTTO, P.Synthetic metals. 1987, Vol 22, Num 2, pp 129-143, issn 0379-6779Article

Hybrid nanotube―graphene junctions: spin degeneracy breaking and tunable electronic structureQU, Zhi-Bei; LI GU; MEINA LI et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 46, pp 20281-20287, issn 1463-9076, 7 p.Article

Structure and bonding trends in two- and three-coordinate boron cationsSCHNEIDER, W. F; NARULA, C. K; NÖTH, H et al.Inorganic chemistry (Print). 1991, Vol 30, Num 20, pp 3919-3927, issn 0020-1669Article

Generalized separable potentials for electronic-structure calculationsBLÖCHL, P. E.Physical review. B, Condensed matter. 1990, Vol 41, Num 8, pp 5414-5416, issn 0163-1829Article

Interplay between electronic structure and correlation through the s-d mixing in transition metal systemsKANAMORI, J.Progress of theoretical physics. Supplement. 1990, Num 101, pp 1-10, issn 0375-9687Article

A theoretical investigation of electron sub-bands of quasi-periodic semiconductor superlatticesGUOYI QIN.Journal of physics. C. Solid state physics. 1988, Vol 21, Num 28, pp 4989-4998, issn 0022-3719Article

An X-ray absorption spectroscopic study of the effect of bond covalency on the electronic structure of Gd2Ti2―xSnxO7RANI ALURI, Esther; GROSVENOR, Andrew P.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 25, pp 10477-10486, issn 1463-9076, 10 p.Article

A complete classification of stable symmetries of the Jahn-Teller systemsBREZA, M.Collection of Czechoslovak chemical communications. 1990, Vol 55, Num 9, pp 2119-2130, issn 0010-0765Article

Modular libraries and literate programming in software for ab initio atomic and molecular electronic structure calculationsBUNGE, C. F; CISNEROS, G.Computers & chemistry. 1988, Vol 12, Num 2, pp 85-89, issn 0097-8485Article

A novel series of photocatalysts M2.5VMoO8 (M = Mg, Zn) for O2 evolution under visible light irradiationWANG, Defa; ZOU, Zhigang; YE, Jinhua et al.Catalysis today. 2004, Vol 93-95, pp 891-894, issn 0920-5861, 4 p.Conference Paper

Theoretical studies on electronic structures of polypeptide chainsTAKEDA, K; SHIRAISHI, K.Journal of the Physical Society of Japan. 1996, Vol 65, Num 2, pp 421-438, issn 0031-9015Article

Theoretical studies on (μ-S2CR) bridged cyclopentadienyl molybdenum dimersPRASAD, B. V; SATYANARAYANA REDDY, C; JEMMIS, E. D et al.Inorganica chimica acta. 1989, Vol 162, Num 2, pp 281-285, issn 0020-1693, 5 p.Article

Electronically induced geometrical catalytic effectsMARKS, L. D; HEINE, V.Journal of catalysis (Print). 1985, Vol 94, Num 2, pp 570-572, issn 0021-9517Article

Electronic structure of the extended vanadyl pyrophosphate (1 0 0) surfaceTHOMPSON, D. J; CIOBICA, I. M; HODNETT, B. K et al.Catalysis today. 2004, Vol 91-92, pp 177-180, issn 0920-5861, 4 p.Conference Paper

Characterization of electronic structure and properties of a bis(histidine) heme model complexSMITH, Davle M. A; DUPUIS, Michel; VORPAGEL, Erich R et al.Journal of the American Chemical Society. 2003, Vol 125, Num 9, pp 2711-2717, issn 0002-7863, 7 p.Article

  • Page / 643