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1

Valence-bond calculations on ZNO and HGO using integrals computed through the semiempirical AM1 method

Miquel Sola, Merce Balcells, Miquel Duran, Agusti Lledos, Juan Bertran

Journal:

International Journal of Quantum Chemistry

Year:

1992

Language:

english

File:

PDF, 501 KB

english, 1992

2

[Lecture Notes in Computer Science] FME '94: Industrial Benefit of Formal Methods Volume 873 || Towards a formalization of programming-by-difference

Naftalin, Maurice, Denvir, Tim, Bertran, Miquel

Year:

1994

Language:

english

File:

PDF, 1.04 MB

english, 1994

3

Hydrogen bonding and aromaticity in the guanine–cytosine base pair interacting with metal cations (M = Cu + , Ca 2+ and Cu 2+ )

Poater, Jordi, Sodupe, Mariona, Bertran *, Joan, Solà *, Miquel

Journal:

Molecular Physics

Year:

2005

Language:

english

File:

PDF, 271 KB

english, 2005

4

[IEEE 2018 IEEE International Symposium on Workload Characterization (IISWC) - Raleigh, NC, USA (2018.9.30-2018.10.2)] 2018 IEEE International Symposium on Workload Characterization (IISWC) - ChopStiX: Systematic Extraction of Code-Representative Microbenchmarks

Bulla, Calvin, Alvarez, Lluc, Moreto, Miquel, Bertran, Ramon, Buyuktosunoglu, Alper, Bose, Pradip

Year:

2018

Language:

english

File:

PDF, 118 KB

english, 2018

5

Theoretical Study of the Effect of Lewis Acids on Dihydrogen Elimination from Niobocene Trihydrides

Santiago Camanyes, Feliu Maseras, Miquel Moreno, Agustí Lledós, José M. Lluch, Juan Bertrán

Journal:

Chemistry - A European Journal

Year:

1999

Language:

english

File:

PDF, 126 KB

english, 1999

6

Lewis-Säuren begünstigen die Umwandlung eines Metallocentrihydrids in einen Diwasserstoffkomplex und die H2-Freisetzung aus ihm: das System [Cp2NbH3] + BH3

Dipl.-Chem. Santiago Camanyes, Dr. Feliu Maseras, Dr. Miquel Moreno, Prof. Dr. Agustí Lledós, Prof. Dr. José M. Lluch, Prof. Dr. Juan Bertrán

Journal:

Angewandte Chemie

Year:

1997

Language:

german

File:

PDF, 499 KB

german, 1997

7

Dihydrogen Formation in a Trihydride Metallocene and Its Elimination, Both Assisted by Lewis Acids: The [Cp2NbH3]+BH3 System

Dipl.-Chem. Santiago Camanyes, Dr. Feliu Maseras, Dr. Miquel Moreno, Prof. Dr. Agustí Lledós, Prof. Dr. José M. Lluch, Prof. Dr. Juan Bertrán

Journal:

Angewandte Chemie International Edition

Year:

1997

Language:

english

File:

PDF, 374 KB

english, 1997

8

Determinants of plasma fatty acid abnormalities in patients with active inflammatory bowel disease: A multivariate analysis

Dr. Maria Esteve-Comas, María Ramirez, Fernando Fernández-Bañares, Agueda Abad-Lacruz, Angel Gil, Eduard Cabré, Ferrán González-Huix, Xavier Bertrán, Miquel Angel Gassull

Journal:

Inflammatory Bowel Diseases

Year:

1995

Language:

english

File:

PDF, 468 KB

english, 1995

9

Theoretical study of the addition of hydrogen halides to olefins: A comparison between (HCl)2 and (HF)2 additions to ethylene

Carmen Clavero, Miquel Duran, Agustí Lledós, Oscar N. Ventura, Juan Bertrán

Journal:

Journal of Computational Chemistry

Year:

1987

Language:

english

File:

PDF, 751 KB

english, 1987

10

Ab initio study of substituent effect on the addition of hydrogen fluoride to fluoroethylenes

Miquel Solà, Agustí Lledós, Miquel Duran, Juan Bertrán, Oscar N. Ventura

Journal:

Journal of Computational Chemistry

Year:

1990

Language:

english

File:

PDF, 1009 KB

english, 1990

11

Vibrational Stark effect: Theoretical determination through the semiempirical AM1 method

Josep Martí, Agustí Lledós, Juan Bertrán, Miquel Duran

Journal:

Journal of Computational Chemistry

Year:

1992

Language:

english

File:

PDF, 836 KB

english, 1992

12

1981 Vigo workshop on signal processing and its applications July 8–10, 1981 at Vigo, Spain

Miquel Bertran-Salvans

Journal:

Signal Processing

Year:

1982

Language:

english

File:

PDF, 117 KB

english, 1982

13

Spectral estimation with rational modeling of the log spectrum

Climent Nadeu, Miquel Bertran-Salvans, Joan Sole´

Journal:

Signal Processing

Year:

1986

Language:

english

File:

PDF, 755 KB

english, 1986

14

A flatness-based generalized optimization approach to spectral estimation

Climent Nadeu, Miquel Bertran

Journal:

Signal Processing

Year:

1990

Language:

english

File:

PDF, 652 KB

english, 1990

15

The Reactivity Of singlet carbenes. An ab initio study

Miquel Moreno, José M. Lluch, Antonio Oliva, Juan Bertrán

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 503 KB

english, 1985

16

Comparison between intramolecular proton transfers involving the carboxylate and alkoxide groups

Enric Bosch, Miquel Moreno, José M. Lluch, Juan Bertrán

Journal:

Chemical Physics

Year:

1990

Language:

english

File:

PDF, 549 KB

english, 1990

17

Calculation of the vibrational frequency and line strength versus applied field of carbon monoxide

José Luis Andrés, Miquel Duran, Agustí Lledós, Juan Bertrán

Journal:

Chemical Physics

Year:

1991

Language:

english

File:

PDF, 736 KB

english, 1991

18

An Input/Output Semantics for Distributed Program Equivalence Reasoning

Miquel Bertran, Francesc-Xavier Babot, August Climent

Journal:

Electronic Notes in Theoretical Computer Science

Year:

2005

Language:

english

File:

PDF, 376 KB

english, 2005

19

Formal Sequentialization of Distributed Systems via Program Rewriting

Miquel Bertran, Francesc Babot, August Climent

Journal:

Electronic Notes in Theoretical Computer Science

Year:

2007

Language:

english

File:

PDF, 419 KB

english, 2007

20

Preface

Miquel Bertran, Teodor Rus

Journal:

Theoretical Computer Science

Year:

2001

Language:

english

File:

PDF, 29 KB

english, 2001

21

Analysis of solvent effect on SN2 reactions by different theoretical models

Carles Alemán, Feliu Maseras, Agustí Lledós, Miquel Duran, Juan Bertrán

Journal:

Journal of Physical Organic Chemistry

Year:

1989

Language:

english

File:

PDF, 791 KB

english, 1989

22

Analysis in terms of valence-bond structures of environmental effects on the electronic structure of molecules

Miquel Solà, Agustí Lledòs, Miquel Duran, Juan Bertràn

Journal:

International Journal of Quantum Chemistry

Year:

1991

Language:

english

File:

PDF, 852 KB

english, 1991

23

Vibrational Stark effect and vibrational static electric properties of N2O

José Luis Andrés, Juan Bertrán, Miquel Duran, Josep Marti

Journal:

International Journal of Quantum Chemistry

Year:

1994

Language:

english

File:

PDF, 494 KB

english, 1994

24

Proton transfer in the water dimer catalyzed by doubly charged cations (Zn+2, Be+2, and Mg+2)

Miquel Solà, Agustí Lledós, Miquel Duran, Juan Bertrán

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1992

Language:

english

File:

PDF, 1003 KB

english, 1992

25

Intrinsic reaction coordinate calculations for reaction paths possessing branching points

Enric Bosch, Miquel Moreno, José M. Lluch, Juan Bertrán

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 469 KB

english, 1989

26

Is there a hydride transfer between N2OH+ and saturated hydrocarbons?

Jordi Mestres, Miquel Duran, Juan Bertrán, Emilio Ballesteros, Marta Herreros, José-Luis M. Abboud

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 739 KB

english, 1995

27

Molecular hydrogen complex vs dihydride in ML4 + H2 systems. Influence of the ML4 fragment geometry

Maseras, Feliu, Duran, Miquel, Lledos, Agusti, Bertran, Juan

Journal:

Inorganic Chemistry

Year:

1989

Language:

english

File:

PDF, 663 KB

english, 1989

28

On a formal definition and application of dimensional design

Miquel Bertran-Salvans

Journal:

Software: Practice and Experience

Year:

1988

Language:

english

File:

PDF, 923 KB

english, 1988

29

The reactivity of triplet carbenes: An ab initio study

Miquel Moreno, José M. Lluch, Antonio Oliva, Juan Bertrán

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1988

Language:

english

File:

PDF, 584 KB

english, 1988

30

Unifying approach to spectral estimation

Bertran-Salvans, Miquel

Journal:

IEE Proceedings F Communications Radar and Signal Processing

Year:

1983

Language:

english

File:

PDF, 410 KB

english, 1983

31

Analysis of solvent effects on the Menshutkin reaction

Sola, Miquel, Lledos, Agusti, Duran, Miquel, Bertran, Juan, Abboud, Jose Luis M.

Journal:

Journal of the American Chemical Society

Year:

1991

Language:

english

File:

PDF, 923 KB

english, 1991

32

Catalysis of Friedel-Crafts reactions by electric fields

Carbonell, Emili, Duran, Miquel, Lledos, Agusti, Bertran, Juan

Journal:

Journal of Physical Chemistry

Year:

1991

Language:

english

File:

PDF, 1.28 MB

english, 1991

33

EGFR mutation analysis in sputum of lung cancer patients: A multitechnique study

Hubers, A. Jasmijn, Heideman, Daniëlle A.M., Yatabe, Yasushi, Wood, Michelle D., Tull, Justyna, Tarón, Miquel, Molina, Miquel A., Mayo, Clara, Bertran-Alamillo, Jordi, Herder, Gerarda J.M., Koning, Re

Journal:

Year:

2013

Language:

english

File:

PDF, 651 KB

english, 2013

34

[Lecture Notes in Computer Science] Transformation-Based Reactive Systems Development Volume 1231 || PLC-automata: A new class of implementable real-time automata

Bertran, Miquel, Rus, Teodor

Year:

1997

Language:

english

File:

PDF, 748 KB

english, 1997

35

Polarized .pi.-frontier molecular orbitals. A method for predicting diastereofacial selectivities

Huang, Xiao Ling, Dannenberg, J. J., Duran, Miquel, Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1993

Language:

english

File:

PDF, 1.63 MB

english, 1993

36

Molecular hydrogen complexes with a hydride ligand. An ab initio study on the iron hydride, [Fe(PR3)4H(H2)]+, system

Maseras, Feliu, Duran, Miquel, Lledos, Agusti, Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1991

Language:

english

File:

PDF, 849 KB

english, 1991

37

Ab initio study of the hydration of carbon dioxide by carbonic anhydrase. A comparison between the Lipscomb and Lindskog mechanisms

Sola, Miquel, Lledos, Agusti, Duran, Miquel, Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 1.16 MB

english, 1992

38

Relaxation or fluctuation of the ionic atmosphere in charge-transfer reactions. An ab initio study of the charge transfer in the (H3O2)- and (FCH3F)- systems

Carbonell, Emili., Andres, Jose L., Lledos, Agusti., Duran, Miquel., Bertran, Juan.

Journal:

Journal of the American Chemical Society

Year:

1988

Language:

english

File:

PDF, 1.37 MB

english, 1988

39

Formal communication elimination and sequentialization equivalence proofs for distributed system models

Miquel Bertran,Francesc Babot,August Climent

Journal:

Acta Informatica

Year:

2014

Language:

english

File:

PDF, 1007 KB

english, 2014

40

Are Anion Radicals Nucleophiles and/or Outersphere Electron Donors? An Ab Initio Study of the Reaction of Ethylene and Formaldehyde Anion Radicals with Methyl Fluoride and Chloride

Bertran, Juan, Gallardo, Iluminada, Moreno, Miquel, Savéant, Jean-Michel

Journal:

Journal of the American Chemical Society

Year:

1996

Language:

english

File:

PDF, 525 KB

english, 1996

41

Quantum Mechanical Hydrogen Exchange Coupling in [(C5H5)Ir(L)H3]+ Complexes (L = PH3, CO). A Combined ab Initio/Tunneling Dynamics Study

Jarid, Abdellah, Moreno, Miquel, Lledos, Agusti, Lluch, Jose M., Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1995

Language:

english

File:

PDF, 797 KB

english, 1995

42

Theoretical study of the addition of hydrogen halides to olefins: reaction of dimeric hydrogen fluoride with ethylene

Clavero, Carmen., Duran, Miquel., Lledos, Agusti., Ventura, Oscar N., Bertran, Juan.

Journal:

Journal of the American Chemical Society

Year:

1986

Language:

english

File:

PDF, 774 KB

english, 1986

43

Acid-catalyzed hydrogenation of olefins. A theoretical study of the hydrogen fluoride and H3O+ catalyzed hydrogenation of ethylene

Siria, Juan Carlos, Duran, Miquel, Lledos, Agusti, Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1987

Language:

english

File:

PDF, 893 KB

english, 1987

44

Molecular electric properties and nuclear and vibrational relaxation

Martí, Josep, Andrés, José Luis, Bertrán, Juan, Duran, Miquel

Journal:

Molecular Physics

Year:

1993

Language:

english

File:

PDF, 554 KB

english, 1993

45

Anion binding and pentacoordination in zinc(II) complexes

Sola, Miquel., Lledos, Agusti., Duran, Miquel., Bertran, Juan.

Journal:

Inorganic Chemistry

Year:

1991

Language:

english

File:

PDF, 663 KB

english, 1991

46

Theoretical Study of the Hydrogen Exchange Coupling in the Metallocene Trihydride Complexes [(C 5 H 5 ) 2 MH 3 ] n + (M = Mo, W, n = 1; M = Nb, Ta, n = 0)

Camanyes, Santiago, Maseras, Feliu, Moreno, Miquel, Lledós, Agustí, Lluch, José M., Bertrán, Juan

Journal:

Journal of the American Chemical Society

Year:

1996

Language:

english

File:

PDF, 172 KB

english, 1996

47

Intramolecular atom exchange between molecular hydrogen and hydride ligands in cis-[Fe(PR3)4H(H2)]+ complexes. An ab initio theoretical study

Maseras, Feliu, Duran, Miquel, Lledos, Agusti, Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 929 KB

english, 1992

48

Dissociative electron transfer. Ab initio study of the carbon-halogen bond reductive cleavage in methyl and perfluoromethyl halides. Role of the solvent

Bertran, Juan, Gallardo, Iluminada, Moreno, Miquel, Saveant, Jean Michel

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 1.05 MB

english, 1992

49

Ab initio calculations of the quantum mechanical hydrogen exchange coupling in the [(C5H5)Ir(PH3)H3]+ complex

Jarid, Abdellah, Moreno, Miquel, Lledos, Agusti, Lluch, Jose M., Bertran, Juan

Journal:

Journal of the American Chemical Society

Year:

1993

Language:

english

File:

PDF, 258 KB

english, 1993

50

Solvent relaxation and proton transfer in the (H5O2)+(H2O)4 species

Muñiz, M. Angeles, Bertrán, Juan, Andrés, Jose L., Duran, Miquel, Lledós, Agustí

Journal:

Journal of the Chemical Society Faraday Transactions 1

Year:

1985

Language:

english

File:

PDF, 557 KB

english, 1985