Kimika Teorikoa

@article{RN2,

title = {Few electron systems confined in Gaussian potential wells and connection to Hooke atoms},

author = {X. Telleria-Allika and J. M. Mercero and J. M. Ugalde and X. Lopez and J. M. Matxain},

url = {<Go to ISI>://WOS:000882059200001},

doi = {10.1002/qua.27043},

issn = {0020-7608},

year  = {2023},

date = {2023-01-01},

journal = {International Journal of Quantum Chemistry},

volume = {123},

number = {5},

note = {Telleria-Allika, Xabier Mercero, Jose M. Ugalde, Jesus M. Lopez, Xabier Matxain, Jon M. 

Lopez, Xabier/G-5690-2015; Ugalde, Jesus/M-2771-2014; Matxain, Jon M./J-8184-2014; Mercero, Jose M./E-6828-2010 

Lopez, Xabier/0000-0002-2711-3588; Ugalde, Jesus/0000-0001-8980-9751; Matxain, Jon M./0000-0002-6342-0649; Mercero, Jose M./0000-0003-4857-6685 

1097-461x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN3,

title = {Aufbau principle and singlet-triplet gap in spherical Hooke atoms},

author = {X. Telleria-Allika and J. M. Ugalde and E. Matito and E. Ramos-Cordoba and M. Rodriuez-Mayorga and X. Lopez},

url = {<Go to ISI>://WOS:000867834000001},

doi = {10.1002/qua.27019},

issn = {0020-7608},

year  = {2023},

date = {2023-01-01},

journal = {International Journal of Quantum Chemistry},

volume = {123},

number = {3},

note = {Telleria-Allika, Xabier Ugalde, Jesus M. Matito, Eduard Ramos-Cordoba, Eloy Rodriguez-Mayorga, Mauricio Lopez, Xabier 

Lopez, Xabier/G-5690-2015; Ugalde, Jesus/M-2771-2014; Matito, Eduard/A-6532-2009; Ramos Cordoba, Eloy/D-2830-2013 

Lopez, Xabier/0000-0002-2711-3588; Ugalde, Jesus/0000-0001-8980-9751; Matito, Eduard/0000-0001-6895-4562; Ramos Cordoba, Eloy/0000-0002-6558-7821 

1097-461x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN4,

title = {A Chirality-Based Quantum Leap},

author = {C. D. Aiello and J. M. Abendroth and M. Abbas and A. Afanasev and S. Agarwal and A. S. Banerjee and D. N. Beratan and J. N. Belling and B. Berche and A. Botana and J. R. Caram and G. L. Celardo and G. Cuniberti and A. Garcia-Etxarri and A. Dianat and I. Diez-Perez and Y. Q. Guo and R. Gutierrez and C. Herrmann and J. Hihath and S. Kale and P. Kurian and Y. C. Lai and T. H. Liu and A. Lopez and E. Medina and V. Mujica and R. Naaman and M. Noormandipour and J. L. Palma and Y. Paltiel and W. Petuskey and J. C. Ribeiro-Silva and J. J. Saenz and E. J. G. Santos and M. Solyanik-Gorgone and V. J. Sorger and D. M. Stemer and J. M. Ugalde and A. Valdes-Curiel and S. Varela and D. H. Waldeck and M. R. Wasielewski and P. S. Weiss and H. Zacharias and Q. H. Wang},

url = {<Go to ISI>://WOS:000813122700001},

doi = {10.1021/acsnano.1c01347},

issn = {1936-0851},

year  = {2022},

date = {2022-01-01},

journal = {Acs Nano},

volume = {16},

number = {4},

pages = {4989-5035},

note = {Aiello, Clarice D. Abendroth, John M. Abbas, Muneer Afanasev, Andrei Agarwal, Shivang Banerjee, Amartya S. Beratan, David N. Belling, Jason N. Berche, Bertrand Botana, Antia Caram, Justin R. Celardo, Giuseppe Luca Cuniberti, Gianaurelio Garcia-Etxarri, Aitzol Dianat, Arezoo Diez-Perez, Ismael Guo, Yuqi Gutierrez, Rafael Herrmann, Carmen Hihath, Joshua Kale, Suneet Kurian, Philip Lai, Ying-Cheng Liu, Tianhan Lopez, Alexander Medina, Ernesto Mujica, Vladimiro Naaman, Ron Noormandipour, Mohammadreza Palma, Julio L. Paltiel, Yossi Petuskey, William Ribeiro-Silva, Joao Carlos Saenz, Juan Jose Santos, Elton J. G. Solyanik-Gorgone, Maria Sorger, Volker J. Stemer, Dominik M. Ugalde, Jesus M. Valdes-Curiel, Ana Varela, Solmar Waldeck, David H. Wasielewski, Michael R. Weiss, Paul S. Zacharias, Helmut Wang, Qing Hua 

Beratan, David N/C-5098-2011; Santos, Elton JG/C-5275-2009; Medina, Ernesto/G-4398-2011; Wang, Qinghua/GVT-3252-2022; Mujica, Vladimiro/GNM-9273-2022; Ribeiro-Silva, Joao Carlos/V-7251-2018; Garcia-Etxarri, Aitzol/L-1965-2019; CUNIBERTI, Gianaurelio/B-7192-2008; Ugalde, Jesus/M-2771-2014 

Beratan, David N/0000-0003-4758-8676; Santos, Elton JG/0000-0001-6065-5787; Medina, Ernesto/0000-0002-1566-0170; Mujica, Vladimiro/0000-0002-5237-4851; Ribeiro-Silva, Joao Carlos/0000-0001-6350-2321; Garcia-Etxarri, Aitzol/0000-0002-5867-2390; CUNIBERTI, Gianaurelio/0000-0002-6574-7848; Ugalde, Jesus/0000-0001-8980-9751; Varela, Solmar/0000-0002-9608-0601; Zacharias, Helmut/0000-0001-9807-1103; Solyanik-Gorgone, Maria/0000-0002-3141-3364; Afanasev, Andrei/0000-0003-0679-3307; Caram, Justin/0000-0001-5126-3829; S. BOTANA, ANTIA/0000-0001-5973-3039; Banerjee, Amartya/0000-0001-5916-9167; AGARWAL, SHIVANG/0000-0001-9231-5461; Stemer, Dominik/0000-0002-5528-1773; Abendroth, John/0000-0002-2369-4311 

1936-086x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN1,

title = {Magnetoresistive Single-Molecule Junctions: the Role of the Spinterface and the CISS Effect},

author = {A. C. Aragones and D. Aravena and J. M. Ugalde and E. Medina and R. Gutierrez and E. Ruiz and V. Mujica and I. Diez-Perez},

url = {<Go to ISI>://WOS:000900343600001},

doi = {10.1002/ijch.202200090},

issn = {0021-2148},

year  = {2022},

date = {2022-01-01},

journal = {Israel Journal of Chemistry},

volume = {62},

number = {11-12},

note = {Aragones, Albert C. Aravena, Daniel Ugalde, Jesus M. Medina, Ernesto Gutierrez, Rafael Ruiz, Eliseo Mujica, Vladimiro Diez-Perez, Ismael 

Ugalde, Jesus/M-2771-2014; Aragonès, Albert C./P-8182-2018; Diez-Perez, Ismael/F-6402-2014 

Ugalde, Jesus/0000-0001-8980-9751; Aragonès, Albert C./0000-0002-1829-6941; Diez-Perez, Ismael/0000-0003-0513-8888 

1869-5868 

Si},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN5,

title = {Experiment and Theory Clarify: Sc+ Receives One Oxygen Atom from SO2 to Form ScO+, which Proves to be a Catalyst for the Hidden Oxygen-Exchange with SO2},

author = {J. M. Mercero and E. Rezabal and J. M. Ugalde and T. Weiske and J. L. Li},

url = {<Go to ISI>://WOS:000744630700001},

doi = {10.1002/cphc.202100773},

issn = {1439-4235},

year  = {2022},

date = {2022-01-01},

journal = {Chemphyschem},

volume = {23},

number = {5},

note = {Mercero, Jose M. Rezabal, Elixabete Ugalde, Jesus M. Weiske, Thomas Li, Jilai 

Mercero, Jose/E-6828-2010; Ugalde, Jesus/M-2771-2014; Li, Jilai/M-5210-2013 

Mercero, Jose/0000-0003-4857-6685; Ugalde, Jesus/0000-0001-8980-9751; Li, Jilai/0000-0002-3363-9164; Weiske, Thomas/0000-0003-4756-2548 

1439-7641},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN280,

title = {Influence of Tartrate Ligand Coordination over Luminescence Properties of Chiral Lanthanide-Based Metal-Organic Frameworks},

author = {U. Huizi-Rayo and X. Gastearena and A. M. Ortuno and J. M. Cuerva and A. Rodriguez-Dieguez and J. A. Garcia and J. Ugalde and J. M. Seco and E. San Sebastian and J. Cepeda},

url = {<Go to ISI>://WOS:000887535600001},

doi = {10.3390/nano12223999},

year  = {2022},

date = {2022-01-01},

journal = {Nanomaterials},

volume = {12},

number = {22},

note = {Huizi-Rayo, Uxua Gastearena, Xuban Ortuno, Ana M. Cuerva, Juan M. Rodriguez-Dieguez, Antonio Garcia, Jose Angel Ugalde, Jesus Seco, Jose Manuel San Sebastian, Eider Cepeda, Javier 

Ruiz, Javier Cepeda/O-9648-2016; San Sebastian, Eider/S-2637-2018; Seco, Jose Manuel/S-2722-2018 

Ruiz, Javier Cepeda/0000-0002-0147-1360; San Sebastian, Eider/0000-0001-9263-9626; Seco, Jose Manuel/0000-0002-5131-6764; Rodriguez Dieguez, Antonio/0000-0003-3198-5378 

2079-4991},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN7,

title = {Electronic Structure and Electron Delocalization in Bare and Dressed Boron Pentamer Clusters},

author = {J. M. Mercero and J. M. Ugalde},

url = {<Go to ISI>://WOS:000668347600003},

doi = {10.1021/acs.jpca.1c02305},

issn = {1089-5639},

year  = {2021},

date = {2021-01-01},

journal = {Journal of Physical Chemistry A},

volume = {125},

number = {24},

pages = {5246-5255},

note = {Mercero, Jose M. Ugalde, Jesus M. 

Ugalde, Jesus/M-2771-2014; Mercero, Jose/E-6828-2010 

Ugalde, Jesus/0000-0001-8980-9751; Mercero, Jose/0000-0003-4857-6685 

1520-5215},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN8,

title = {Chemical reactivity studies by the natural orbital functional second-order Moller-Plesset (NOF-MP2) method: water dehydrogenation by the scandium cation},

author = {J. M. Mercero and J. M. Ugalde and M. Piris},

url = {<Go to ISI>://WOS:000656459800001},

doi = {10.1007/s00214-021-02775-4},

issn = {1432-881X},

year  = {2021},

date = {2021-01-01},

journal = {Theoretical Chemistry Accounts},

volume = {140},

number = {6},

note = {Mercero, Jose M. Ugalde, Jesus M. Piris, Mario 

Ugalde, Jesus/M-2771-2014; Piris, Mario/E-7406-2010; Mercero, Jose/E-6828-2010 

Ugalde, Jesus/0000-0001-8980-9751; Piris, Mario/0000-0003-0222-2953; Mercero, Jose/0000-0003-4857-6685 

1432-2234},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN6,

title = {Extended enantiopure ortho-phenylene ethylene (o-OPE)-based helical systems as scaffolds for supramolecular architectures: a study of chiroptical response and its connection to the CISS effect},

author = {A. M. Ortuno and P. Reine and S. Resa and L. A. Cienfuegos and V. Blanco and J. M. Paredes and A. J. Mota and G. Mazzeo and S. Abbate and J. M. Ugalde and V. Mujica and G. Longhi and D. Miguel and J. M. Cuerva},

url = {<Go to ISI>://WOS:000674051900001},

doi = {10.1039/d1qo00822f},

issn = {2052-4129},

year  = {2021},

date = {2021-01-01},

journal = {Organic Chemistry Frontiers},

volume = {8},

number = {18},

pages = {5071-5086},

note = {Ortuno, Ana M. Reine, Pablo Resa, Sandra Alvarez de Cienfuegos, Luis Blanco, Victor Paredes, Jose Manuel Mota, Antonio J. Mazzeo, Giuseppe Abbate, Sergio Ugalde, Jesus M. Mujica, Vladimiro Longhi, Giovanna Miguel, Delia Cuerva, Juan Manuel 

de Cienfuegos, Luis Alvarez/K-2391-2014; Blanco, Victor/K-4612-2014; Resa, Sandra/Y-6356-2019; Mujica, Vladimiro/GNM-9273-2022; Miguel, Delia/K-4947-2014; Blanco, Victor/ABF-9548-2021; M.Paredes, Jose/M-3494-2014; Mazzeo, Giuseppe/D-1984-2017; Ortuño, Ana M./AGR-3100-2022; Ugalde, Jesus/M-2771-2014 

de Cienfuegos, Luis Alvarez/0000-0001-8910-4241; Blanco, Victor/0000-0002-6809-079X; Resa, Sandra/0000-0003-1170-4268; Mujica, Vladimiro/0000-0002-5237-4851; Blanco, Victor/0000-0002-6809-079X; M.Paredes, Jose/0000-0002-3252-9174; Mazzeo, Giuseppe/0000-0002-3819-6438; Ugalde, Jesus/0000-0001-8980-9751; ABBATE, Sergio/0000-0001-9359-1214; Mota Avila, Antonio Jose/0000-0001-6137-1006; Ortuno Guzman, Ana Maria/0000-0001-8562-7248},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN11,

title = {Field-Mediated Chirality Information Transfer in Molecule-Nanoparticle Hybrids},

author = {A. Garcia-Etxarri and J. M. Ugalde and J. J. Saenz and V. Mujica},

url = {<Go to ISI>://WOS:000508467700037},

doi = {10.1021/acs.jpcc.9b07670},

issn = {1932-7447},

year  = {2020},

date = {2020-01-01},

journal = {Journal of Physical Chemistry C},

volume = {124},

number = {2},

pages = {1560-1565},

note = {Garcia-Etxarri, Aitzol Ugalde, Jesus M. Jose Saenz, Juan Mujica, Vladimiro 

Mujica, Vladimiro/GNM-9273-2022; Ugalde, Jesus/M-2771-2014; Garcia-Etxarri, Aitzol I/B-7311-2008; Garcia-Etxarri, Aitzol/L-1965-2019; Saenz, Juan Jose/F-8871-2010 

Mujica, Vladimiro/0000-0002-5237-4851; Ugalde, Jesus/0000-0001-8980-9751; Garcia-Etxarri, Aitzol I/0000-0002-5867-2390; Garcia-Etxarri, Aitzol/0000-0002-5867-2390; Saenz, Juan Jose/0000-0002-1411-5648 

1932-7455},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN9,

title = {An Ideal Spin Filter: Long-Range, High-Spin Selectivity in Chiral Helicoidal 3-Dimensional Metal Organic Frameworks},

author = {U. Huizi-Rayo and J. Gutierrez and J. M. Seco and V. Mujica and I. Diez-Perez and J. M. Ugalde and A. Tercjak and J. Cepeda and E. San Sebastian},

url = {<Go to ISI>://WOS:000599507100010},

doi = {10.1021/acs.nanolett.0c02349},

issn = {1530-6984},

year  = {2020},

date = {2020-01-01},

journal = {Nano Letters},

volume = {20},

number = {12},

pages = {8476-8482},

note = {Huizi-Rayo, Uxua Gutierrez, Junkal Seco, Jose Manuel Mujica, Vladimiro Diez-Perez, Ismael Ugalde, Jesus M. Tercjak, Agnieszka Cepeda, Javier San Sebastian, Eider 

Mujica, Vladimiro/GNM-9273-2022; San Sebastian, Eider/S-2637-2018; Seco, Jose Manuel/S-2722-2018; Ugalde, Jesus/M-2771-2014; Ruiz, Javier Cepeda/O-9648-2016; Huizi-Rayo, Uxua/ABD-2689-2020; Diez-Perez, Ismael/F-6402-2014; Gutierrez, Junkal/F-6200-2017 

Mujica, Vladimiro/0000-0002-5237-4851; San Sebastian, Eider/0000-0001-9263-9626; Seco, Jose Manuel/0000-0002-5131-6764; Ugalde, Jesus/0000-0001-8980-9751; Ruiz, Javier Cepeda/0000-0002-0147-1360; Huizi-Rayo, Uxua/0000-0002-2162-9516; Diez-Perez, Ismael/0000-0003-0513-8888; Gutierrez, Junkal/0000-0001-5553-0162; Tercjak, Agnieszka/0000-0002-5277-1830 

1530-6992},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN10,

title = {Enantiospecific Response in Cross-Polarization Solid-State Nuclear Magnetic Resonance of Optically Active Metal Organic Frameworks},

author = {E. San Sebastian and J. Cepeda and U. Huizi-Rayo and A. Terenzi and D. Finkelstein-Shapiro and D. Padro and J. I. Santos and J. M. Matxain and J. M. Ugalde and V. Mujica},

url = {<Go to ISI>://WOS:000580559000022},

doi = {10.1021/jacs.0c04537},

issn = {0002-7863},

year  = {2020},

date = {2020-01-01},

journal = {Journal of the American Chemical Society},

volume = {142},

number = {42},

pages = {17989-17996},

note = {San Sebastian, Eider Cepeda, Javier Huizi-Rayo, Uxua Terenzi, Alessio Finkelstein-Shapiro, Daniel Padro, Daniel Santos, Jose Ignacio Matxain, Jon M. Ugalde, Jesus M. Mujica, Vladimiro 

Santos, José I./AAH-1969-2019; Terenzi, Alessio/K-5525-2019; Ugalde, Jesus/M-2771-2014; Padro, Daniel/AAG-3529-2021; Ruiz, Javier Cepeda/O-9648-2016; Huizi-Rayo, Uxua/ABD-2689-2020; San Sebastian, Eider/S-2637-2018; Mujica, Vladimiro/GNM-9273-2022; Matxain, Jon M./J-8184-2014 

Santos, José I./0000-0002-5199-2332; Terenzi, Alessio/0000-0001-9751-1373; Ugalde, Jesus/0000-0001-8980-9751; Padro, Daniel/0000-0002-3932-9351; Ruiz, Javier Cepeda/0000-0002-0147-1360; Huizi-Rayo, Uxua/0000-0002-2162-9516; San Sebastian, Eider/0000-0001-9263-9626; Mujica, Vladimiro/0000-0002-5237-4851; Finkelstein Shapiro, Daniel/0000-0001-8015-5376; Matxain, Jon M./0000-0002-6342-0649 

1520-5126},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN12,

title = {Tetravalent Oxygen and Sulphur Centres Mediated by Carborane Superacid: Theoretical Analysis},

author = {S. J. Grabowski and D. Casanova and E. Formoso and J. M. Ugalde},

url = {<Go to ISI>://WOS:000484328700001},

doi = {10.1002/cphc.201900687},

issn = {1439-4235},

year  = {2019},

date = {2019-01-01},

journal = {Chemphyschem},

volume = {20},

number = {19},

pages = {2443-2450},

note = {Grabowski, Slawomir J. Casanova, David Formoso, Elena Ugalde, Jesus M. 

Formoso, Elena/E-6834-2010; Casanova, David/F-9752-2011; Ugalde, Jesus/M-2771-2014 

Formoso, Elena/0000-0002-7106-3717; Casanova, David/0000-0002-8893-7089; Ugalde, Jesus/0000-0001-8980-9751 

1439-7641},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN13,

title = {Chirality Induced Spin Selectivity of Photoexcited Electrons in Carbon-Sulfur n Helicenes},

author = {J. M. Matxain and J. M. Ugalde and V. Mujica and S. I. Allec and B. M. Wong and D. Casanova},

url = {<Go to ISI>://WOS:000477152300001},

doi = {10.1002/cptc.201900128},

issn = {2367-0932},

year  = {2019},

date = {2019-01-01},

journal = {Chemphotochem},

volume = {3},

number = {9},

pages = {770-777},

note = {Matxain, Jon M. Ugalde, Jesus M. Mujica, Vladimiro Allec, Sarah, I Wong, Bryan M. Casanova, David 

Casanova, David/F-9752-2011; Ugalde, Jesus/M-2771-2014; Wong, Bryan/B-1663-2009; Mujica, Vladimiro/GNM-9273-2022 

Casanova, David/0000-0002-8893-7089; Ugalde, Jesus/0000-0001-8980-9751; Wong, Bryan/0000-0002-3477-8043; Mujica, Vladimiro/0000-0002-5237-4851 

Si},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN16,

title = {The Coulomb Hole of the Ne Atom},

author = {M. Rodriguez-Mayorga and E. Ramos-Cordoba and X. Lopez and M. Sola and J. M. Ugalde and E. Matito},

url = {<Go to ISI>://WOS:000472717000004},

doi = {10.1002/open.201800235},

issn = {2191-1363},

year  = {2019},

date = {2019-01-01},

journal = {Chemistryopen},

volume = {8},

number = {4},

pages = {411-417},

note = {Rodriguez-Mayorga, Mauricio Ramos-Cordoba, Eloy Lopez, Xabier Sola, Miquel Ugalde, Jesus M. Matito, Eduard 

Ugalde, Jesus/M-2771-2014; Lopez, Xabier/G-5690-2015; Ramos-Cordoba, Eloy/D-2830-2013; Rodriguez Mayorga, Mauricio/AHB-2658-2022; Matito, Eduard/A-6532-2009; Solà, Miquel/A-6155-2009 

Ugalde, Jesus/0000-0001-8980-9751; Lopez, Xabier/0000-0002-2711-3588; Ramos-Cordoba, Eloy/0000-0002-6558-7821; Rodriguez Mayorga, Mauricio/0000-0003-0869-9787; Matito, Eduard/0000-0001-6895-4562; Solà, Miquel/0000-0002-1917-7450},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN15,

title = {Selective Transmission of Phonons in Molecular Junctions with Nanoscopic Thermal Baths},

author = {L. M. Sandonas and A. R. Mendez and R. Gutierrez and J. M. Ugalde and V. Mujica and G. Cuniberti},

url = {<Go to ISI>://WOS:000465488600004},

doi = {10.1021/acs.jpcc.8b11879},

issn = {1932-7447},

year  = {2019},

date = {2019-01-01},

journal = {Journal of Physical Chemistry C},

volume = {123},

number = {15},

pages = {9680-9687},

note = {Sandonas, Leonardo Medrano Mendez, Alvaro Rodriguez Gutierrez, Rafael Ugalde, Jesus M. Mujica, Vladimir Cuniberti, Gianaurelio 

Mujica, Vladimiro/GNM-9273-2022; CUNIBERTI, Gianaurelio/B-7192-2008; Ugalde, Jesus/M-2771-2014; Sandonas, Leonardo Medrano/Y-1413-2019; Gutierrez, Rafael/G-3573-2010 

Mujica, Vladimiro/0000-0002-5237-4851; CUNIBERTI, Gianaurelio/0000-0002-6574-7848; Ugalde, Jesus/0000-0001-8980-9751; Sandonas, Leonardo Medrano/0000-0002-7673-3142; Gutierrez, Rafael/0000-0003-2090-1140; Gutierrez, Rafael/0000-0001-8121-8041},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN14,

title = {Reply to "Comment on 'Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid-State Cross-Polarization Nuclear Magnetic Resonance'"},

author = {J. I. Santos and I. Rivilla and F. P. Cossio and F. J. Garcia-Garcia and J. M. Matxain and M. Grzeliczak and S. K. S. Mazinani and J. M. Ugalde and V. Mujica},

url = {<Go to ISI>://WOS:000473248300003},

doi = {10.1021/acsnano.9b00946},

issn = {1936-0851},

year  = {2019},

date = {2019-01-01},

journal = {Acs Nano},

volume = {13},

number = {6},

pages = {6133-6136},

note = {Santos, Jose I. Rivilla, Ivan Cossio, Fernando P. Javier Garcia-Garcia, F. Matxain, Jon M. Grzeliczak, Marek Mazinani, Shobeir K. S. Ugalde, Jesus M. Mujica, Vladimir 

Matxain, Jon M./J-8184-2014; Mujica, Vladimiro/GNM-9273-2022; Santos, José I./AAH-1969-2019; Ugalde, Jesus/M-2771-2014; Rivilla, Iván/H-5643-2016 

Matxain, Jon M./0000-0002-6342-0649; Mujica, Vladimiro/0000-0002-5237-4851; Santos, José I./0000-0002-5199-2332; Ugalde, Jesus/0000-0001-8980-9751; Rivilla, Iván/0000-0003-1984-7183; Cossio, Fernando P./0000-0002-4526-2122; Grzelczak, Marek/0000-0002-3458-8450 

1936-086x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN17,

title = {Methane activation by alternant N2O2 (center dot+) and N2S2 (center dot+) cluster radical cations},

author = {E. N. Szlapa and X. Lopez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000457635000009},

doi = {10.1016/j.ijms.2018.12.015},

issn = {1387-3806},

year  = {2019},

date = {2019-01-01},

journal = {International Journal of Mass Spectrometry},

volume = {438},

pages = {72-77},

note = {Szlapa, Ewa N. Lopez, Xabier Ugalde, Jesus M. 

Lopez, Xabier/G-5690-2015; Szlapa, Ewa/W-3768-2019; Ugalde, Jesus/M-2771-2014 

Lopez, Xabier/0000-0002-2711-3588; Szlapa, Ewa/0000-0001-6866-7045; Ugalde, Jesus/0000-0001-8980-9751 

1873-2798},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN21,

title = {The stability of biradicaloid versus closed-shell E(mu-XR) (2) (E = P, As; X = N, P, As) rings. Does aromaticity play a role? (vol 18, pg 11879, 2016)},

author = {R. Grande-Aztatzi and J. M. Mercero and J. M. Ugalde},

url = {<Go to ISI>://WOS:000431824000089},

doi = {10.1039/c8cp91727b},

issn = {1463-9076},

year  = {2018},

date = {2018-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {20},

number = {17},

pages = {12323-12323},

note = {Grande-Aztatzi, Rafael Mercero, Jose M. Ugalde, Jesus M. 

Ugalde, Jesus/M-2771-2014 

Ugalde, Jesus/0000-0001-8980-9751 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN20,

title = {Probing the structures and bonding of auropolyynes, Au (C C)(n) Au- (n=1-3), using high-resolution photoelectron imaging},

author = {I. Leon and F. Ruiperez and J. M. Ugalde and L. S. Wang},

url = {<Go to ISI>://WOS:000447149500024},

doi = {10.1063/1.5040336},

issn = {0021-9606},

year  = {2018},

date = {2018-01-01},

journal = {Journal of Chemical Physics},

volume = {149},

number = {14},

note = {Leon, Iker Ruiperez, Fernando Ugalde, Jesus M. Wang, Lai-Sheng 

Ruiperez, Fernando/H-9744-2013; Ugalde, Jesus/M-2771-2014; leon, i/GZL-2093-2022 

Ruiperez, Fernando/0000-0002-5585-245X; Ugalde, Jesus/0000-0001-8980-9751; 

1089-7690},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN113,

title = {Electron-Pair Distribution in Chemical Bond Formation},

author = {M. Rodriguez-Mayorga and M. Via-Nadal and M. Sola and J. M. Ugalde and X. Lopez and E. Matito},

url = {<Go to ISI>://WOS:000426221000010},

doi = {10.1021/acs.jpca.7b12556},

issn = {1089-5639},

year  = {2018},

date = {2018-01-01},

journal = {Journal of Physical Chemistry A},

volume = {122},

number = {7},

pages = {1916-+},

note = {Rodriguez-Mayorga, M. Via-Nadal, M. Sola, M. Ugalde, J. M. Lopez, X. Matito, E. 

Lopez, Xabier/G-5690-2015; Ugalde, Jesus/M-2771-2014; Solà, Miquel/A-6155-2009; Matito, Eduard/A-6532-2009; Rodriguez Mayorga, Mauricio/AHB-2658-2022 

Lopez, Xabier/0000-0002-2711-3588; Ugalde, Jesus/0000-0001-8980-9751; Solà, Miquel/0000-0002-1917-7450; Matito, Eduard/0000-0001-6895-4562; Rodriguez Mayorga, Mauricio/0000-0003-0869-9787 

1520-5215},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN19,

title = {Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid-State Cross-Polarization Nuclear Magnetic Resonance},

author = {J. I. Santos and I. Rivilla and F. P. Cossio and J. M. Matxain and M. Grzelczak and S. K. S. Mazinani and J. M. Ugalde and V. Mujica},

url = {<Go to ISI>://WOS:000451789200082},

doi = {10.1021/acsnano.8b06467},

issn = {1936-0851},

year  = {2018},

date = {2018-01-01},

journal = {Acs Nano},

volume = {12},

number = {11},

pages = {11426-11433},

note = {Santos, Jose I. Rivilla, Ivan Cossio, Fernando P. Matxain, Jon M. Grzelczak, Marek Mazinani, Shobeir K. S. Ugalde, Jesus M. Mujica, Vladimiro 

Mujica, Vladimiro/GNM-9273-2022; Ugalde, Jesus/M-2771-2014; Santos, José I./AAH-1969-2019; Matxain, Jon M./J-8184-2014; Rivilla, Iván/H-5643-2016 

Mujica, Vladimiro/0000-0002-5237-4851; Ugalde, Jesus/0000-0001-8980-9751; Santos, José I./0000-0002-5199-2332; Matxain, Jon M./0000-0002-6342-0649; Rivilla, Iván/0000-0003-1984-7183; Cossio, Fernando P./0000-0002-4526-2122; Grzelczak, Marek/0000-0002-3458-8450 

1936-086x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN27,

title = {Measuring the Spin-Polarization Power of a Single Chiral Molecule},

author = {A. C. Aragones and E. Medina and M. Ferrer-Huerta and N. Gimeno and M. Teixido and J. L. Palma and N. J. Tao and J. M. Ugalde and E. Giralt and I. Diez-Perez and V. Mujica},

url = {<Go to ISI>://WOS:000396564600014},

doi = {10.1002/smll.201602519},

issn = {1613-6810},

year  = {2017},

date = {2017-01-01},

journal = {Small},

volume = {13},

number = {2},

note = {Aragones, Albert C. Medina, Ernesto Ferrer-Huerta, Miriam Gimeno, Nuria Teixido, Meritxell Palma, Julio L. Tao, Nongjian Ugalde, Jesus M. Giralt, Ernest Diez-Perez, Ismael Mujica, Vladimiro 

Ugalde, Jesus/M-2771-2014; teixido, meritxell/I-3282-2015; Tao, NJ/B-1628-2008; Medina, Ernesto/G-4398-2011; Mujica, Vladimiro/GNM-9273-2022; Aragonès, Albert C./P-8182-2018; Diez-Perez, Ismael/F-6402-2014 

Ugalde, Jesus/0000-0001-8980-9751; teixido, meritxell/0000-0002-7825-3695; Medina, Ernesto/0000-0002-1566-0170; Mujica, Vladimiro/0000-0002-5237-4851; Aragonès, Albert C./0000-0002-1829-6941; Ferrer Huerta, Miriam/0000-0002-7076-1177; Diez-Perez, Ismael/0000-0003-0513-8888 

1613-6829},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN25,

title = {The aromaticity of dicupra 10 annulenes},

author = {R. Grande-Aztatzi and J. M. Mercero and E. Matito and G. Frenking and J. M. Ugalde},

url = {<Go to ISI>://WOS:000399164400036},

doi = {10.1039/c7cp00092h},

issn = {1463-9076},

year  = {2017},

date = {2017-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {19},

number = {14},

pages = {9669-9675},

note = {Grande-Aztatzi, Rafael Mercero, Jose M. Matito, Eduard Frenking, Gernot Ugalde, Jesus M. 

Grande-Aztatzi, Rafael/G-4660-2015; Matito, Eduard/A-6532-2009; Mercero, Jose/E-6828-2010; Ugalde, Jesus/M-2771-2014 

Grande-Aztatzi, Rafael/0000-0002-1919-4883; Matito, Eduard/0000-0001-6895-4562; Mercero, Jose/0000-0003-4857-6685; Ugalde, Jesus/0000-0001-8980-9751 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN24,

title = {The aromaticity of dicupra 10 annulenes (vol 19, pg 9669, 2017)},

author = {R. Grande-Aztatzi and J. M. Mercero and E. Matito and G. Frenking and J. M. Ugalde},

url = {<Go to ISI>://WOS:000400862400028},

doi = {10.1039/c7cp90082a},

issn = {1463-9076},

year  = {2017},

date = {2017-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {19},

number = {17},

pages = {10951-10951},

note = {Grande-Aztatzi, Rafael Mercero, Jose M. Matito, Eduard Frenking, Gernot Ugalde, Jesus M. 

Mercero, Jose/E-6828-2010; Matito, Eduard/A-6532-2009; Ugalde, Jesus/M-2771-2014 

Mercero, Jose/0000-0003-4857-6685; Matito, Eduard/0000-0001-6895-4562; Ugalde, Jesus/0000-0001-8980-9751 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN23,

title = {Elucidating the 3D structures of Al(III)-A beta complexes: a template free strategy based on the pre-organization hypothesis},

author = {J. I. Mujika and J. R. G. Pedregal and X. Lopez and J. M. Ugalde and L. Rodriguez-Santiago and M. Sodupe and J. D. Marechal},

url = {<Go to ISI>://WOS:000404617300040},

doi = {10.1039/c7sc01296a},

issn = {2041-6520},

year  = {2017},

date = {2017-01-01},

journal = {Chemical Science},

volume = {8},

number = {7},

pages = {5041-5049},

note = {Mujika, Jon I. Rodriguez-Guerra Pedregal, Jaime Lopez, Xabier Ugalde, Jesus M. Rodriguez-Santiago, Luis Sodupe, Mariona Marechal, Jean-Didier 

Lopez, Xabier/G-5690-2015; Sodupe, Mariona/E-9352-2013; Rodriguez-Santiago, Luis/K-7029-2013; Maréchal, Jean-Didier P/A-8936-2012; Ugalde, Jesus/M-2771-2014; Pedregal, Jaime Rodríguez-Guerra/J-3127-2019; Mujika, Jon/H-7132-2012 

Lopez, Xabier/0000-0002-2711-3588; Sodupe, Mariona/0000-0003-0276-0524; Rodriguez-Santiago, Luis/0000-0003-4983-4228; Maréchal, Jean-Didier P/0000-0002-8344-9043; Ugalde, Jesus/0000-0001-8980-9751; Pedregal, Jaime Rodríguez-Guerra/0000-0001-8974-1566; Mujika, Jon/0000-0002-4584-7497 

2041-6539},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN114,

title = {The trans Effect in Palladium Phosphine Sulfonate Complexes},

author = {E. Rezabal and J. M. Ugalde and G. Frenking},

url = {<Go to ISI>://WOS:000413131300030},

doi = {10.1021/acs.jpca.7b06856},

issn = {1089-5639},

year  = {2017},

date = {2017-01-01},

journal = {Journal of Physical Chemistry A},

volume = {121},

number = {40},

pages = {7709-7716},

note = {Rezabal, E. Ugalde, J. M. Frenking, G. 

ASTIGARRAGA, ELIXABETE REZABAL/X-6011-2019; Ugalde, Jesus/M-2771-2014 

ASTIGARRAGA, ELIXABETE REZABAL/0000-0003-0397-6140; Ugalde, Jesus/0000-0001-8980-9751},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN26,

title = {Experimental and Theoretical Study of a Cadmium Coordination Polymer Based on Aminonicotinate with Second-Timescale Blue/Green Photoluminescent Emission},

author = {J. M. Seco and A. Rodriguez-Dieguez and D. Padro and J. A. Garcia and J. M. Ugalde and E. S. Sebastian and J. Cepeda},

url = {<Go to ISI>://WOS:000397171100008},

doi = {10.1021/acs.inorgchem.7b00110},

issn = {0020-1669},

year  = {2017},

date = {2017-01-01},

journal = {Inorganic Chemistry},

volume = {56},

number = {6},

pages = {3149-3152},

note = {Seco, Jose M. Rodriguez-Dieguez, Antonio Padro, Daniel Garcia, Jose A. Ugalde, Jesus M. Sebastian, Eider San Cepeda, Javier 

Padro, Daniel/L-4091-2015; San Sebastian, Eider/S-2637-2018; Seco, Jose Manuel/S-2722-2018; Ruiz, Javier Cepeda/O-9648-2016; Padro, Daniel/AAG-3529-2021; Ugalde, Jesus/M-2771-2014; biomaGUNE, CIC/J-9136-2014 

Padro, Daniel/0000-0002-3932-9351; San Sebastian, Eider/0000-0001-9263-9626; Seco, Jose Manuel/0000-0002-5131-6764; Ruiz, Javier Cepeda/0000-0002-0147-1360; Padro, Daniel/0000-0002-3932-9351; Ugalde, Jesus/0000-0001-8980-9751; biomaGUNE, CIC/0000-0001-7690-0660 

1520-510x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN22,

title = {Photosensitization mechanism of Cu(II) porphyrinst},

author = {J. Uranga and J. M. Matxain and X. Lopez and J. M. Ugalde and D. Casanova},

url = {<Go to ISI>://WOS:000407763700023},

doi = {10.1039/c7cp03319b},

issn = {1463-9076},

year  = {2017},

date = {2017-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {19},

number = {31},

pages = {20533-20540},

note = {Uranga, Jon Matxain, Jon M. Lopez, Xabier Ugalde, Jesus M. Casanova, David 

Casanova, David/F-9752-2011; Matxain, Jon M./J-8184-2014; Lopez, Xabier/G-5690-2015; Uranga, Jon/ABC-3945-2021; Ugalde, Jesus/M-2771-2014 

Casanova, David/0000-0002-8893-7089; Matxain, Jon M./0000-0002-6342-0649; Lopez, Xabier/0000-0002-2711-3588; Uranga, Jon/0000-0002-1256-6656; Ugalde, Jesus/0000-0001-8980-9751 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN28,

title = {Aromaticity, the Huckel 4n+2 Rule and Magnetic Current},

author = {L. L. Zhao and R. Grande-Aztatzi and C. Foroutan-Nejad and J. M. Ugalde and G. Frenking},

url = {<Go to ISI>://WOS:000395533100003},

doi = {10.1002/slct.201602080},

issn = {2365-6549},

year  = {2017},

date = {2017-01-01},

journal = {Chemistryselect},

volume = {2},

number = {3},

pages = {863-870},

note = {Zhao, Lili Grande-Aztatzi, Rafael Foroutan-Nejad, Cina Ugalde, Jesus M. Frenking, Gernot 

Foroutan-Nejad, Cina/I-7512-2013; Grande-Aztatzi, Rafael/G-4660-2015; Ugalde, Jesus/M-2771-2014 

Foroutan-Nejad, Cina/0000-0003-0755-8173; Grande-Aztatzi, Rafael/0000-0002-1919-4883; Ugalde, Jesus/0000-0001-8980-9751},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN32,

title = {Plasmonic Resonances in the Al-13(-) Cluster: Quantification and Origin of Exciton Collectivity},

author = {D. Casanova and J. M. Matxain and J. M. Ugalde},

url = {<Go to ISI>://WOS:000378196200044},

doi = {10.1021/acs.jpcc.6b03210},

issn = {1932-7447},

year  = {2016},

date = {2016-01-01},

journal = {Journal of Physical Chemistry C},

volume = {120},

number = {23},

pages = {12742-12750},

note = {Casanova, David Matxain, Jon M. Ugalde, Jesus M. 

Ugalde, Jesus/M-2771-2014; Casanova, David/F-9752-2011; Matxain, Jon M./J-8184-2014 

Ugalde, Jesus/0000-0001-8980-9751; Casanova, David/0000-0002-8893-7089; Matxain, Jon M./0000-0002-6342-0649},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN38,

title = {A Zn based coordination polymer exhibiting long-lasting phosphorescence},

author = {J. Cepeda and E. S. Sebastian and D. Padro and A. Rodriguez-Dieguez and J. A. Garcia and J. M. Ugalde and J. M. Seco},

url = {<Go to ISI>://WOS:000379484200006},

doi = {10.1039/c6cc03242g},

issn = {1359-7345},

year  = {2016},

date = {2016-01-01},

journal = {Chemical Communications},

volume = {52},

number = {56},

pages = {8671-8674},

note = {Cepeda, Javier San Sebastian, Eider Padro, Daniel Rodriguez-Dieguez, Antonio Garcia, Jose A. Ugalde, Jesus M. Seco, Jose M. 

Ugalde, Jesus/M-2771-2014; Ruiz, Javier Cepeda/O-9648-2016; Padro, Daniel/AAG-3529-2021; Seco, Jose Manuel/S-2722-2018; Padro, Daniel/L-4091-2015; San Sebastian, Eider/S-2637-2018; biomaGUNE, CIC/J-9136-2014 

Ugalde, Jesus/0000-0001-8980-9751; Ruiz, Javier Cepeda/0000-0002-0147-1360; Padro, Daniel/0000-0002-3932-9351; Seco, Jose Manuel/0000-0002-5131-6764; Padro, Daniel/0000-0002-3932-9351; San Sebastian, Eider/0000-0001-9263-9626; Rodriguez Dieguez, Antonio/0000-0003-3198-5378; biomaGUNE, CIC/0000-0001-7690-0660 

1364-548x},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN33,

title = {Cholesterol-Ceramide Interactions in Phospholipid and Sphingolipid Bilayers As Observed by Positron Annihilation Lifetime Spectroscopy and Molecular Dynamics Simulations},

author = {A. B. Garcia-Arribas and E. Axpe and J. I. Mujika and D. Merida and J. V. Busto and J. Sot and A. Alonso and X. Lopez and J. A. Garcia and J. M. Ugalde and F. Plazaola and F. M. Goni},

url = {<Go to ISI>://WOS:000377151300025},

doi = {10.1021/acs.langmuir.6b00927},

issn = {0743-7463},

year  = {2016},

date = {2016-01-01},

journal = {Langmuir},

volume = {32},

number = {21},

pages = {5434-5444},

note = {Garcia-Arribas, Aritz B. Axpe, Eneko Inaki Mujika, Jon Merida, David Busto, Jon V. Sot, Jesus Alonso, Alicia Lopez, Xabier Angel Garcia, Jose Ugalde, Jesus M. Plazaola, Fernando Goni, Felix M. 

Goni, Felix M/M-5425-2015; Alonso, Alicia/E-5310-2012; Lopez, Xabier/G-5690-2015; Ugalde, Jesus/M-2771-2014 

Goni, Felix M/0000-0001-6270-9216; Alonso, Alicia/0000-0002-2730-7470; Lopez, Xabier/0000-0002-2711-3588; Ugalde, Jesus/0000-0001-8980-9751; Plazaola Muguruza, Fernando/0000-0002-0081-8131; Sot, Jesus/0000-0001-9508-6596; Axpe, Eneko/0000-0002-9114-5306; Garcia Arribas, Aritz/0000-0003-1866-6647},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN31,

title = {Comparison of Hydrogen and Gold Bonding in XHX (-), XAuX (-), and Isoelectronic NgHNg (+), NgAuNg (+) (X=Halogen},

author = {S. J. Grabowski and J. M. Ugalde and D. M. Andrada and G. Frenking},

url = {<Go to ISI>://WOS:000382918700031},

doi = {10.1002/chem.201601392},

issn = {0947-6539},

year  = {2016},

date = {2016-01-01},

journal = {Chemistry-a European Journal},

volume = {22},

number = {32},

pages = {11317-11328},

note = {Grabowski, Slawomir J. Ugalde, Jesus M. Andrada, Diego M. Frenking, Gernot 

Andrada, Diego M/A-1702-2015; Grabowski, Slawomir J/N-3119-2014; Ugalde, Jesus/M-2771-2014; Andrada, Diego/AFP-0969-2022 

Andrada, Diego M/0000-0003-2515-7859; Ugalde, Jesus/0000-0001-8980-9751; Andrada, Diego/0000-0003-2515-7859 

1521-3765},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN35,

title = {Structural and optical properties of the naked and passivated Al5Au5 bimetallic nanoclusters},

author = {R. Grande-Aztatzi and E. Formoso and J. M. Mercero and J. M. Matxain and S. J. Grabowski and J. M. Ugalde},

url = {<Go to ISI>://WOS:000373384100019},

doi = {10.1063/1.4943129},

issn = {0021-9606},

year  = {2016},

date = {2016-01-01},

journal = {Journal of Chemical Physics},

volume = {144},

number = {11},

note = {Grande-Aztatzi, Rafael Formoso, Elena Mercero, Jose M. Matxain, Jon M. Grabowski, Slawomir J. Ugalde, Jesus M. 

Mercero, Jose/E-6828-2010; Grabowski, Slawomir J/N-3119-2014; Formoso, Elena/E-6834-2010; Grande-Aztatzi, Rafael/G-4660-2015; Ugalde, Jesus/M-2771-2014; Matxain, Jon M./J-8184-2014 

Mercero, Jose/0000-0003-4857-6685; Formoso, Elena/0000-0002-7106-3717; Grande-Aztatzi, Rafael/0000-0002-1919-4883; Ugalde, Jesus/0000-0001-8980-9751; Matxain, Jon M./0000-0002-6342-0649 

1089-7690},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN36,

title = {Phosphorylation promotes Al(III) binding to proteins: GEGEGSGG as a case study},

author = {R. Grande-Aztatzi and E. Formoso and J. I. Mujika and J. M. Ugalde and X. Lopez},

url = {<Go to ISI>://WOS:000371608600028},

doi = {10.1039/c5cp06379e},

issn = {1463-9076},

year  = {2016},

date = {2016-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {18},

number = {10},

pages = {7197-7207},

note = {Grande-Aztatzi, Rafael Formoso, Elena Mujika, Jon I. Ugalde, Jesus M. Lopez, Xabier 

Formoso, Elena/E-6834-2010; Grande-Aztatzi, Rafael/G-4660-2015; Ugalde, Jesus/M-2771-2014; Lopez, Xabier/G-5690-2015; Mujika, Jon/H-7132-2012 

Formoso, Elena/0000-0002-7106-3717; Grande-Aztatzi, Rafael/0000-0002-1919-4883; Ugalde, Jesus/0000-0001-8980-9751; Lopez, Xabier/0000-0002-2711-3588; Mujika, Jon/0000-0002-4584-7497 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN34,

title = {The stability of biradicaloid versus closed-shell E(mu-XR) (2) (E = P, As; X = N, P, As) rings. Does aromaticity play a role?},

author = {R. Grande-Aztatzi and J. M. Mercero and J. M. Ugalde},

url = {<Go to ISI>://WOS:000375623100034},

doi = {10.1039/c5cp07263h},

issn = {1463-9076},

year  = {2016},

date = {2016-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {18},

number = {17},

pages = {11879-11884},

note = {Grande-Aztatzi, Rafael Mercero, Jose M. Ugalde, Jesus M. 

Mercero, Jose/E-6828-2010; Ugalde, Jesus/M-2771-2014; Grande-Aztatzi, Rafael/G-4660-2015 

Mercero, Jose/0000-0003-4857-6685; Ugalde, Jesus/0000-0001-8980-9751; Grande-Aztatzi, Rafael/0000-0002-1919-4883 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN30,

title = {Probing the electronic structure and Au-C chemical bonding in AuCn- and AuCnH- (n=2, 4, and 6) using high-resolution photoelectron spectroscopy},

author = {I. Leon and F. Ruiperez and J. M. Ugalde and L. S. Wang},

url = {<Go to ISI>://WOS:000381680300016},

doi = {10.1063/1.4960440},

issn = {0021-9606},

year  = {2016},

date = {2016-01-01},

journal = {Journal of Chemical Physics},

volume = {145},

number = {6},

note = {Leon, Iker Ruiperez, Fernando Ugalde, Jesus M. Wang, Lai-Sheng 

León, Iker/C-2031-2014; Ugalde, Jesus/M-2771-2014; leon, i/GZL-2093-2022; Ruiperez, Fernando/H-9744-2013 

León, Iker/0000-0002-1992-935X; Ugalde, Jesus/0000-0001-8980-9751; Ruiperez, Fernando/0000-0002-5585-245X 

1089-7690},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN116,

title = {Exact exchange-correlation functional for the infinitely stretched hydrogen molecule},

author = {E. Matito and D. Casanova and X. Lopez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000382131900001},

doi = {10.1007/s00214-016-1982-x},

issn = {1432-881X},

year  = {2016},

date = {2016-01-01},

journal = {Theoretical Chemistry Accounts},

volume = {135},

number = {9},

note = {Matito, E. Casanova, D. Lopez, X. Ugalde, J. M. 

Casanova, David/F-9752-2011; Matito, Eduard/A-6532-2009; Lopez, Xabier/G-5690-2015; Ugalde, Jesus/M-2771-2014 

Casanova, David/0000-0002-8893-7089; Matito, Eduard/0000-0001-6895-4562; Lopez, Xabier/0000-0002-2711-3588; Ugalde, Jesus/0000-0001-8980-9751 

1432-2234},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN115,

title = {The electron-pair density distribution of the (1,3)Pi(u) excited states of H-2},

author = {J. M. Mercero and M. Rodriguez-Mayorga and E. Matito and X. Lopez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000390320300003},

doi = {10.1139/cjc-2016-0203},

issn = {0008-4042},

year  = {2016},

date = {2016-01-01},

journal = {Canadian Journal of Chemistry},

volume = {94},

number = {12},

pages = {998-1001},

note = {Mercero, J. M. Rodriguez-Mayorga, M. Matito, E. Lopez, X. Ugalde, J. M. 

Lopez, Xabier/G-5690-2015; Matito, Eduard/A-6532-2009; Ugalde, Jesus/M-2771-2014; Mercero, Jose/E-6828-2010; Rodriguez Mayorga, Mauricio/AHB-2658-2022 

Lopez, Xabier/0000-0002-2711-3588; Matito, Eduard/0000-0001-6895-4562; Ugalde, Jesus/0000-0001-8980-9751; Mercero, Jose/0000-0003-4857-6685; Rodriguez Mayorga, Mauricio/0000-0003-0869-9787 

1480-3291 

Si},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN37,

title = {The Bond Order of C-2 from a Strictly N-Representable Natural Orbital Energy Functional Perspective},

author = {M. Piris and X. Lopez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000372526500028},

doi = {10.1002/chem.201504491},

issn = {0947-6539},

year  = {2016},

date = {2016-01-01},

journal = {Chemistry-a European Journal},

volume = {22},

number = {12},

pages = {4109-4115},

note = {Piris, Mario Lopez, Xabier Ugalde, Jesus M. 

Piris, Mario/E-7406-2010; Ugalde, Jesus/M-2771-2014; Lopez, Xabier/G-5690-2015 

Piris, Mario/0000-0003-0222-2953; Ugalde, Jesus/0000-0001-8980-9751; Lopez, Xabier/0000-0002-2711-3588 

1521-3765},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN29,

title = {4th International Conference on Chemical Bonding},

author = {J. M. Ugalde and P. Bultinck and F. M. Bickelhaupt and A. N. Alexandrova},

url = {<Go to ISI>://WOS:000389160900001},

doi = {10.1021/acs.jpca.6b11179},

issn = {1089-5639},

year  = {2016},

date = {2016-01-01},

journal = {Journal of Physical Chemistry A},

volume = {120},

number = {47},

pages = {9353-9356},

note = {Ugalde, Jesus M. Bultinck, Patrick Bickelhaupt, F. Matthias Alexandrova, Anastassia N. 

Ugalde, Jesus/M-2771-2014; Bultinck, Patrick/E-4716-2011; Bickelhaupt, F. Matthias/A-3857-2009 

Ugalde, Jesus/0000-0001-8980-9751; Bultinck, Patrick/0000-0003-2766-2672; Bickelhaupt, F. Matthias/0000-0003-4655-7747 

1520-5215},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN117,

title = {Ceramide increases free volume voids in DPPC membranes},

author = {E. Axpe and A. B. Garcia-Arribas and J. I. Mujika and D. Merida and A. Alonso and X. Lopez and J. A. Garcia and J. M. Ugalde and F. M. Goni and F. Plazaola},

url = {<Go to ISI>://WOS:000354964900045},

doi = {10.1039/c5ra05142h},

issn = {2046-2069},

year  = {2015},

date = {2015-01-01},

journal = {Rsc Advances},

volume = {5},

number = {55},

pages = {44282-44290},

note = {Axpe, E. Garcia-Arribas, A. B. Mujika, J. I. Merida, D. Alonso, A. Lopez, X. Garcia, J. A. Ugalde, J. M. Goni, F. M. Plazaola, F. 

Alonso, Alicia/E-5310-2012; Lopez, Xabier/G-5690-2015; Goni, Felix M/M-5425-2015; Mujika, Jon/H-7132-2012; Ugalde, Jesus/M-2771-2014 

Alonso, Alicia/0000-0002-2730-7470; Lopez, Xabier/0000-0002-2711-3588; Goni, Felix M/0000-0001-6270-9216; Mujika, Jon/0000-0002-4584-7497; Ugalde, Jesus/0000-0001-8980-9751; Garcia Arribas, Aritz/0000-0003-1866-6647; Plazaola Muguruza, Fernando/0000-0002-0081-8131; Axpe, Eneko/0000-0002-9114-5306},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN43,

title = {The effect of TiO2 surface on the electron injection efficiency in PbS quantum dot solar cells: a first-principles study},

author = {J. M. Azpiroz and J. M. Ugalde and L. Etgar and I. Infante and F. De Angelis},

url = {<Go to ISI>://WOS:000349697200063},

doi = {10.1039/c4cp04976d},

issn = {1463-9076},

year  = {2015},

date = {2015-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {17},

number = {8},

pages = {6076-6086},

note = {Azpiroz, Jon M. Ugalde, Jesus M. Etgar, Lioz Infante, Ivan De Angelis, Filippo 

Ugalde, Jesus/M-2771-2014; Infante, Ivan/A-1912-2011; De Angelis, Filippo/N-4341-2015 

Ugalde, Jesus/0000-0001-8980-9751; Infante, Ivan/0000-0003-3467-9376; De Angelis, Filippo/0000-0003-3833-1975 

1463-9084},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN40,

title = {Performance of PNOF6 for Hydrogen Abstraction Reactions},

author = {X. Lopez and M. Piris and F. Ruiperez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000357963400005},

doi = {10.1021/acs.jpca.5b01585},

issn = {1089-5639},

year  = {2015},

date = {2015-01-01},

journal = {Journal of Physical Chemistry A},

volume = {119},

number = {27},

pages = {6981-6988},

note = {Lopez, Xabier Piris, Mario Ruiperez, Fernando Ugalde, Jesus M. 

Ruiperez, Fernando/H-9744-2013; Ugalde, Jesus/M-2771-2014; Lopez, Xabier/G-5690-2015; Piris, Mario/E-7406-2010 

Ruiperez, Fernando/0000-0002-5585-245X; Ugalde, Jesus/0000-0001-8980-9751; Lopez, Xabier/0000-0002-2711-3588; Piris, Mario/0000-0003-0222-2953},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN44,

title = {Recent developments and future prospects of all-metal aromatic compounds},

author = {J. M. Mercero and A. I. Boldyrev and G. Merino and J. M. Ugalde},

url = {<Go to ISI>://WOS:000360654900010},

doi = {10.1039/c5cs00341e},

issn = {0306-0012},

year  = {2015},

date = {2015-01-01},

journal = {Chemical Society Reviews},

volume = {44},

number = {18},

pages = {6519-6534},

note = {Mercero, Jose M. Boldyrev, Alexander I. Merino, Gabriel Ugalde, Jesus M. 

Mercero, Jose/E-6828-2010; Merino, Gabriel/A-1046-2009; Ugalde, Jesus/M-2771-2014; Boldyrev, Alexander I./C-5940-2009 

Mercero, Jose/0000-0003-4857-6685; Ugalde, Jesus/0000-0001-8980-9751; Boldyrev, Alexander I./0000-0002-8277-3669 

1460-4744},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN41,

title = {The Electronic Structure of the Al-3(-) Anion: Is it Aromatic?},

author = {J. M. Mercero and E. Matito and F. Ruiperez and I. Infante and X. Lopez and J. M. Ugalde},

url = {<Go to ISI>://WOS:000357027300003},

doi = {10.1002/chem.201501350},

issn = {0947-6539},

year  = {2015},

date = {2015-01-01},

journal = {Chemistry-a European Journal},

volume = {21},

number = {27},

pages = {9610-9614},

note = {Mercero, Jose M. Matito, Eduard Ruiperez, Fernando Infante, Ivan Lopez, Xabier Ugalde, Jesus M. 

Infante, Ivan/A-1912-2011; Mercero, Jose/E-6828-2010; Ugalde, Jesus/M-2771-2014; Ruiperez, Fernando/H-9744-2013; Lopez, Xabier/G-5690-2015; Matito, Eduard/A-6532-2009 

Infante, Ivan/0000-0003-3467-9376; Mercero, Jose/0000-0003-4857-6685; Ugalde, Jesus/0000-0001-8980-9751; Ruiperez, Fernando/0000-0002-5585-245X; Lopez, Xabier/0000-0002-2711-3588; Matito, Eduard/0000-0001-6895-4562 

1521-3765},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RN42,

title = {Homopolymerization of Ethylene by Palladium Phosphine Sulfonate Catalysts: The Role of Structural and Environmental Factors},

author = {E. Rezabal and J. M. Asua and J. M. Ugalde},

url = {<Go to ISI>://WOS:000347864300046},

doi = {10.1021/om5011947},

issn = {0276-7333},

year  = {2015},

date = {2015-01-01},

journal = {Organometallics},

volume = {34},

number = {1},

pages = {373-380},

note = {Rezabal, Elixabete Asua, Jose M. Ugalde, Jesus M. 

Ugalde, Jesus/M-2771-2014; ASTIGARRAGA, ELIXABETE REZABAL/X-6011-2019; Asua, Jose M/B-2288-2015 

Ugalde, Jesus/0000-0001-8980-9751; ASTIGARRAGA, ELIXABETE REZABAL/0000-0003-0397-6140; 

1520-6041},

keywords = {},

pubstate = {published},

tppubtype = {article}

}