J. Alkorta: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

Don't use scam websites

51

Structures, Binding Energies, and Spin–Spin Coupling Constants of Geometric Isomers of Pnicogen Homodimers (PHFX) 2 , X = F, Cl, CN, CH 3 , NC

Del Bene, Janet E., Alkorta, Ibon, Sanchez-Sanz, Goar, Elguero, José

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 777 KB

english, 2012

52

The origin of the splitting of 13C and 15N NMR signals of 3(5)-phenyl-5(3)-methylpyrazolium chloride and bromide in the solid state: Quantum Espresso calculations

Alkorta, Ibon, Claramunt, Rosa M., Elguero, José, Ferraro, Marta B., Facelli, Julio C., Provasi, Patricio F., Reviriego, Felipe

Journal:

Journal of Molecular Structure

Year:

2014

Language:

english

File:

PDF, 1.36 MB

english, 2014

53

Cooperativity between the hydrogen bonding and halogen bonding in F 3 CX ··· NCH(CNH) ··· NCH(CNH) complexes (X=Cl, Br)

Solimannejad, Mohammad, Malekani, Masumeh, Alkorta, Ibon

Journal:

Molecular Physics

Year:

2011

Language:

english

File:

PDF, 480 KB

english, 2011

54

Bioluminescent Bacterial Biosensors for the Assessment of Metal Toxicity and Bioavailability in Soils

Alkorta, I., Epelde, L., Mijangos, I., Amezaga, I., Garbisu, C.

Journal:

Reviews on Environmental Health

Year:

2006

Language:

english

File:

PDF, 1.70 MB

english, 2006

55

Ramsey terms for two-, three-, and four-bond coupling involving 15 N and 17 O in hydrogen-bonded and nonhydrogen-bonded systems: are coupling constants sensitive to RAHBs?

Elguero, José, Alkorta, Ibon, Del Bene, Janet E.

Journal:

Molecular Physics

Year:

2014

Language:

english

File:

PDF, 409 KB

english, 2014

56

3-(2-Pyridyl)-[1,2,3]triazolo[1,5-a]pyridines. An experimental and theoretical (DFT) study of the ring–chain isomerization

Abarca, Belén, Alkorta, Ibon, Ballesteros, Rafael, Blanco, Fernando, Chadlaoui, Mimoun, Elguero, José, Mojarrad, Fatemeh

Journal:

Organic & Biomolecular Chemistry

Year:

2005

Language:

english

File:

PDF, 241 KB

english, 2005

57

On the transferability of atomic contributions to the optical rotatory power of hydrogen peroxide, methyl hydroperoxide and dimethyl peroxide

Sánchez, Marina, Alkorta, Ibon, Elguero, José, Ferraro, Marta B., Sauer, Stephan P.A.

Journal:

Molecular Physics

Year:

2014

Language:

english

File:

PDF, 451 KB

english, 2014

58

Spontaneous proton transfers induced by beryllium bonds

Mó, Otilia, Yáñez, Manuel, Alkorta, Ibon, Elguero, José

Journal:

Molecular Physics

Year:

2014

Language:

english

File:

PDF, 532 KB

english, 2014

59

A theoretical study of the thermodynamic and hydrogen-bond basicity of TEMPO radical and related nitroxides

Alkorta, Ibon, Elguero, José

Journal:

Structural Chemistry

Year:

2014

Language:

english

File:

PDF, 841 KB

english, 2014

60

The Paradox of Hydrogen-Bonded Anion–Anion Aggregates in Oxoanions: A Fundamental Electrostatic Problem Explained in Terms of Electrophilic···Nucleophilic Interactions

Mata, Ignasi, Molins, Elies, Alkorta, Ibon, Espinosa, Enrique

Journal:

Journal of Physical Chemistry A

Year:

2015

Language:

english

File:

PDF, 769 KB

english, 2015

61

Adaptive Long-Term Monitoring of Soil Health in Metal Phytostabilization: Ecological Attributes and Ecosystem Services Based on Soil Microbial Parametersxs

Epelde, Lur, Becerril, José M., Alkorta, Itziar, Garbisu, Carlos

Journal:

International Journal of Phytoremediation

Year:

2014

Language:

english

File:

PDF, 294 KB

english, 2014

62

Phytoremediation: A Technology Using Green Plants to Remove Contaminants from Polluted Areas

Garbisu, C., Allica, J.H., Barrutia, O., Alkorta, I., Becerril, J.M.

Journal:

Reviews on Environmental Health

Year:

2002

Language:

english

File:

PDF, 1.90 MB

english, 2002

63

Assessment of elastic anisotropy and incipient plasticity in Fe3C by nanoindentation

Alkorta, Jon, Sevillano, Javier Gil

Journal:

Journal of Materials Research

Year:

2012

Language:

english

File:

PDF, 357 KB

english, 2012

64

Adding Only One Priority Rule Allows Extending CIP Rules to Supramolecular Systems

Alkorta, Ibon, Elguero, José, Cintas, Pedro

Journal:

Year:

2015

Language:

english

File:

PDF, 682 KB

english, 2015

65

Microstructure and Indentation Size-Effect in Pure Niobium Subjected to SPD via ECAP and HPT

Alkorta, Jon, Luis Pérez, C.J., Popova, E.N., Hafok, Martin, Pippan, Reinhard, Gil Sevillano, J.

Journal:

Materials Science Forum

Year:

2008

Language:

english

File:

PDF, 6.69 MB

english, 2008

66

Soil Enzyme Activities as Biological Indicators of Soil Health

Alkorta, Itziar, Aizpurua, Ana, Riga, Patrick, Albizu, Isabel, Amézaga, Ibone, Garbisu, Carlos

Journal:

Reviews on Environmental Health

Year:

2003

Language:

english

File:

PDF, 1.03 MB

english, 2003

67

Phytostabilization of Metal Contaminated Soils

Alkorta, I., Becerril, J.M., Garbisu, C.

Journal:

Reviews on Environmental Health

Year:

2010

Language:

english

File:

PDF, 1023 KB

english, 2010

68

Dendroremediation of Heavy Metal Polluted Soils

Gonzälez-Oreja, J.A., Rozas, MA, Alkorta, I., Garbisu, C.

Journal:

Reviews on Environmental Health

Year:

2008

Language:

english

File:

PDF, 1.52 MB

english, 2008

69

Synthesis, 1H and 13C NMR Study of Pyrazoles Derived from Chiral Cyclohexanones (3-Methylcyclohexanone, Menthone, Pulegone, Dihydrocarvone and Carvone)

Hafez Hussien Elghandour, Ahmed, Faure, Robert, Frideling, Aline, Galy, Jean-Pierre, Alkorta, Ibon, Elguero, José

Journal:

Year:

2002

Language:

english

File:

PDF, 106 KB

english, 2002

70

Reflections on soil contamination research from a biologist́s point of view

Gómez-Sagasti, María Teresa, Epelde, Lur, Alkorta, Itziar, Garbisu, Carlos

Journal:

Applied Soil Ecology

Year:

2016

Language:

english

File:

PDF, 253 KB

english, 2016

71

The 1 H NMR spectrum of pyrazole in a nematic phase

Provasi, Patricio, Jimeno, María Luisa, Alkorta, Ibon, Reviriego, Felipe, Elguero, José, Jokisaari, Jukka

Journal:

Magnetic Resonance in Chemistry

Year:

2016

Language:

english

File:

PDF, 761 KB

english, 2016

72

Lipid-Modified Oligonucleotide Conjugates: Insights into Gene Silencing, Interaction with Model Membranes and Cellular Uptake Mechanisms

Ugarte-Uribe, Begoña, Grijalvo, Santiago, Núñez Pertíñez, Samuel, Busto, Jon V., Martín, César, Alagia, Adele, Goñi, Félix M., Eritja, Ramón, Alkorta, Itziar

Journal:

Bioorganic & Medicinal Chemistry

Year:

2016

Language:

english

File:

PDF, 1.38 MB

english, 2016

73

Long-term effects of aided phytostabilisation on microbial communities of metal-contaminated mine soil

Garaiyurrebaso, Olatz, Garbisu, Carlos, Blanco, Fernando, Lanzén, Anders, Martín, Iker, Epelde, Lur, Becerril, José M., Jechalke, Sven, Smalla, Kornelia, Grohmann, Elisabeth, Alkorta, Itziar, Sessitsc

Journal:

FEMS Microbiology Ecology

Year:

2017

Language:

english

File:

PDF, 1.81 MB

english, 2017

74

Trapping one electron between three beryllium atoms. Very strong one-electron three-center bonds

Alkorta, Ibon, Montero-Campillo, M. Merced, Elguero, Jose, Yañez, Manuel, Mo, Otilia

Journal:

Year:

2018

Language:

english

File:

PDF, 2.20 MB

english, 2018

75

Weak interactions and cooperativity effects on disiloxane: a look at the building block of silicones

Martín-Fernández, Carlos, Montero-Campillo, M. Merced, Alkorta, Ibon, Elguero, José

Journal:

Molecular Physics

Year:

2018

Language:

english

File:

PDF, 1.14 MB

english, 2018

76

Plasmid-Mediated Bioaugmentation for the Bioremediation of Contaminated Soils

Garbisu, Carlos, Garaiyurrebaso, Olatz, Epelde, Lur, Grohmann, Elisabeth, Alkorta, Itziar

Journal:

Frontiers in Microbiology

Year:

2017

Language:

english

File:

PDF, 930 KB

english, 2017

77

Adsorption sensitivity of pristine and Al- or Si-doped boron nitride nanoflake to COCl 2 : a DFT study

Moladoust, Roghayeh, Esrafili, Mehdi D., Hosseinian, Akram, Alkorta, Ibon, Vessally, Esmail

Journal:

Molecular Physics

Year:

2018

Language:

english

File:

PDF, 2.08 MB

english, 2018

78

Exploring N C Tetrel and O S Chalcogen Bonds in HN(CH)SX:OCS Systems, for X = F, NC, Cl, CN, CCH, and H

Del Bene, Janet E., Alkorta, Ibon, Elguero, José

Journal:

Chemical Physics Letters

Year:

2019

Language:

english

File:

PDF, 678 KB

english, 2019

79

Potential Energy Surfaces of HN(CH)SX:CO 2 for X = F, Cl, NC, CN, CCH, and H: N···C Tetrel Bonds and O···S Chalcogen Bonds

Del Bene, Janet E., Alkorta, Ibon, Elguero, José

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 1013 KB

english, 2019

80

Are Anions of Cyclobutane Beryllium Derivatives Stabilized Through Four-Center One-Electron Bonds?

MÃ³, Otilia, Montero-Campillo, M. Merced, YÃ¡Ã±ez, Manuel, Alkorta, Ibon, Elguero, JosÃ©

Journal:

Journal of Physical Chemistry A

Year:

2020

File:

PDF, 652 KB

2020

81

Regium Bonds between Silver(I) Pyrazolates Dinuclear Complexes and Lewis Bases (N2, OH2, NCH, SH2, NH3, PH3, CO and CNH)

Alkorta, Ibon, Trujillo, Cristina, SÃ¡nchez-Sanz, Goar, Elguero, JosÃ©

Journal:

Year:

2020

Language:

english

File:

PDF, 1.98 MB

english, 2020

82

Mutual Influence of Pnicogen Bonds and Beryllium Bonds: Energies and Structures in the Spotlight

Alkorta, Ibon, Elguero, JosÃ©, Del Bene, Janet E., Mo Romero, Otilia, Montero-Campillo, M. Merced, YÃ¡Ã±ez, Manuel

Journal:

Journal of Physical Chemistry A

Year:

2020

File:

PDF, 535 KB

2020

83

An Interacting Quantum Atoms (IQA) and Relative Energy Gradient (REG) Study of the Halogen Bond with Explicit Analysis of Electron Correlation

Alkorta, Ibon, Silva, Arnaldo F., Popelier, Paul L. A.

Journal:

Year:

2020

File:

PDF, 1.92 MB

2020

84

Surrogacy in Spain: Vindication of the Mater Semper Certa Est Rule

Alkorta, Itziar

Journal:

The New Bioethics

Year:

2020

File:

PDF, 483 KB

2020

85

The Importance of Strain (Preorganization) in Beryllium Bonds

Alkorta, Ibon, Elguero, JosÃ©, Oliva-Enrich, Josep M., YÃ¡Ã±ez, Manuel, MÃ³, Otilia, Montero-Campillo, M. Merced

Journal:

Year:

2020

File:

PDF, 2.58 MB

2020

86

Molecular polarization potential maps of the nucleic acid bases

Ibon Alkorta, Juan J. Perez

Journal:

International Journal of Quantum Chemistry

Year:

1996

Language:

english

File:

PDF, 1.58 MB

english, 1996

87

Utilization of genetically engineered microorganisms (GEMs) for bioremediation

Carlos Garbisu, Itziar Alkorta

Journal:

Journal of Chemical Technology & Biotechnology

Year:

1999

Language:

english

File:

PDF, 97 KB

english, 1999

88

Theoretical and experimental analysis of properties in heterocycles containing the aminosulphonylamino moiety

Ibon Alkorta, Concepción García-Gómez, Juan Antonio Páez, Pilar Goya

Journal:

Journal of Physical Organic Chemistry

Year:

1996

Language:

english

File:

PDF, 545 KB

english, 1996

89

4-Nitropyrazole: a nitrogen or an oxygen base in the gas phase?

José-Luis M. Abboud, Rafael Notario, Manuel Yáñez, Otilia Mó, Robert Flammang, Nadine Jagerovic, Ibon Alkorta, José Elguero

Journal:

Journal of Physical Organic Chemistry

Year:

1999

Language:

english

File:

PDF, 109 KB

english, 1999

90

Wassercluster: auf dem Weg zu einem Verständnis anhand von Grundprinzipien ihrer statischen und dynamischen Eigenschaften

Jesus M. Ugalde, Ibon Alkorta, José Elguero

Journal:

Angewandte Chemie

Year:

2000

Language:

german

File:

PDF, 128 KB

german, 2000

91

Water Clusters: Towards an Understanding Based on First Principles of Their Static and Dynamic Properties

Jesus M. Ugalde, Ibon Alkorta, José Elguero

Journal:

Angewandte Chemie International Edition

Year:

2000

Language:

english

File:

PDF, 137 KB

english, 2000

92

Basicity of N-H- and N-Methyl-1,2,3-triazoles in the Gas Phase, in Solution, and in the Solid State − An Experimental and Theoretical Study

José-Luis M. Abboud, Concepción Foces-Foces, Rafael Notario, Rostislav E. Trifonov, Anna P. Volovodenko, Vladimir A. Ostrovskii, Ibon Alkorta, José Elguero

Journal:

European Journal of Organic Chemistry

Year:

2001

Language:

english

File:

PDF, 483 KB

english, 2001

93

Basicity of 1-nitroaryl-4,5-dihydropyrazoles: pKa measurements and theoretical calculations

Ibon Alkorta, Emmanuel Gonzalez, Nadine Jagerovic, José Elguero, Robert Flammang

Journal:

Journal of Physical Organic Chemistry

Year:

2000

Language:

english

File:

PDF, 125 KB

english, 2000

94

In situ Neutron Diffraction Study of Internal Micro-Stresses Developed by Plastic Elongation in &&num;60;110&&num;62; Textured BCC Wires

J. Gil Sevillano, J. Alkorta, D. González, S. Van Petegem, U. Stuhr, H. Van Swygenhoven

Journal:

Advanced Engineering Materials

Year:

2008

Language:

english

File:

PDF, 284 KB

english, 2008

95

Stereoelectronic, Strain, and Medium Effects on the Protonation of Cubylamine, a Janus-like Base

José-Luis M. Abboud, Ilmar A. Koppel, Ibon Alkorta, Ernest W. Della, Paul Müller, Juan Z. Dávalos, Peeter Burk, Ivar Koppel, Viljar Pihl, Esther Quintanilla

Journal:

Angewandte Chemie

Year:

2003

Language:

english

File:

PDF, 117 KB

english, 2003

96

Stereoelectronic, Strain, and Medium Effects on the Protonation of Cubylamine, a Janus-like Base

José-Luis M. Abboud, Ilmar A. Koppel, Ibon Alkorta, Ernest W. Della, Paul Müller, Juan Z. Dávalos, Peeter Burk, Ivar Koppel, Viljar Pihl, Esther Quintanilla

Journal:

Angewandte Chemie International Edition

Year:

2003

Language:

english

File:

PDF, 118 KB

english, 2003

97

Synthesis, Characterization, Molecular Structure and Theoretical Studies of Axially Fluoro-Substituted Subazaporphyrins

M. Salomé Rodríguez-Morgade, Christian G. Claessens, Anaïs Medina, David González-Rodríguez, Enrique Gutiérrez-Puebla, Angeles Monge, Ibon Alkorta, José Elguero, Tomás Torres

Journal:

Chemistry - A European Journal

Year:

2008

Language:

english

File:

PDF, 402 KB

english, 2008

98

Synthesis and Preferred All-syn Conformation of C3-Symmetrical N-(Hetero)arylmethyl Triindoles

Eva M. García-Frutos, Berta Gómez-Lor, Ángeles Monge, Enrique Gutiérrez-Puebla, Ibon Alkorta, José Elguero

Journal:

Chemistry - A European Journal

Year:

2008

Language:

english

File:

PDF, 510 KB

english, 2008

99

Cover Picture: Synthesis, Characterization, Molecular Structure and Theoretical Studies of Axially Fluoro-Substituted Subazaporphyrins (Chem. Eur. J. 4/2008)

M. Salomé Rodríguez-Morgade, Christian G. Claessens, Anaïs Medina, David González-Rodríguez, Enrique Gutiérrez-Puebla, Angeles Monge, Ibon Alkorta, José Elguero, Tomás Torres

Journal:

Chemistry - A European Journal

Year:

2008

Language:

english

File:

PDF, 1020 KB

english, 2008

100

1,2,4-Diazaphospholide Complexes of Tin(II): From Nitride Stannylene to Stannylenated Ammonium Ions

Chengfu Pi, José Elguero, Li Wan, Ibon Alkorta, Wenjun Zheng, Linhong Weng, Zhenxia Chen, Limin Wu

Journal:

Chemistry - A European Journal

Year:

2009

Language:

english

File:

PDF, 273 KB

english, 2009