2 research outputs found
Efficacy of surface error corrections to density functional theory calculations of vacancy formation energy in transition metals
- Publication venue
- 'IOP Publishing'
- Publication date
- 01/09/2010
- Field of study
We calculate properties like equilibrium lattice parameter, bulk modulus and
monovacancy formation energy for nickel (Ni), iron (Fe) and chromium (Cr) using
Kohn-Sham density functional theory (DFT). We compare relative performance of
local density approximation (LDA) and generalized gradient approximation (GGA)
for predicting such physical properties for these metals. We also make a
relative study between two different flavors of GGA exchange correlation
functional, namely, PW91 and PBE. These calculations show that there is a
discrepancy between DFT calculations and experimental data. In order to
understand this discrepancy in the calculation of vacancy formation energy, we
introduce a correction for the surface intrinsic error corresponding to an
exchange correlation functional using the scheme implemented by Mattsson et al.
[Phys. Rev. B 73, 195123 (2006)] and compare the effectiveness of the
correction scheme for Al and the 3d-transition metals.Comment: 29 pages, 3 figures, 5 tables, Published in J. Phys: Cond. Matt.
vol.22 (2010) 34550
Transverse momentum spectra of charged particles in proton–proton collisions at √s=900 GeV with ALICE at the LHC
- Author
- Aamodt Kenneth
- Abel N.
- Abeysekara U.
- Abrahantes Quintana A.
- Abramyan A.
- Adamová Dagmar
- Aggarwal Madan Mohan
- Aglieri Rinella Gianluca
- Agocs A.G.
- Aguilar Salazar S.
- Ahammed Zubayer
- Ahmad A.
- Ahmad Nazeer
- Ahn Sang Un
- Akimoto R.
- Akindinov Alexander
- Aleksandrov Dmitry
- Alessandro Bruno
- Alfaro Molina Jose Ruben
- Alici Andrea
- Almaráz Aviña E.
- Alme Johan
- Alt Torsten
- Altini V.
- Altinpinar Sedat
- Andrei Cristian
- Andronic Anton
- Anelli G.
- Angelov V.
- Anson Christopher Daniel
- Antinori Federico
- Antinori S.
- Antipin K.
- Antičić Tome
- Antonioli Pietro
- Antończyk Dariusz
- Anzo A.
- Aphecetche Laurent Bernard
- Appelshäuser Harald
- Arcelli Silvia
- Arceo R.
- Arend A.
- Armesto Néstor
- Arnaldi Roberta
- Aronsson Tomas Robert
- Arsene Ionut Cristian
- Asryan A.
- Augustinus Andre
- Averbeck Ralf Peter
- Awes T.C.
- Azmi Mohd Danish
- Bablok Sebastian
- Bach Matthias
- Badalà Angela
- Baek Yong Wook
- Bagnasco Stefano
- Bailhache Raphaëlle
- Bala Remu
- Baldisseri Alberto
- Baldit A.
- Barbera Roberto
- Barile Francesco
- Barnaföldi Gergely Gábor
- Barnby L.
- Barret Valerie
- Bartke Jerzy
- Basile Maurizio
- Basmanov V.
- Bastid Nicole
- Bathen Bastian
- Batigne Guillaume
- Batyunya Boris
- Baumann C.
- Bearden Ian Gardner
- Becker B.
- Belikov Iouri
- Bellwied Rene
- Belmont-Moreno Ernesto
- Belogianni A.
- Benhabib L.
- Beolè Stefania
- Berceanu Ionela
- Bercuci Alexandru
- Berdermann E.
- Berdnikov Yaroslav
- Betev Latchezar
- Bhasin Anju
- Bhati Ashok Kumar
- Bianchi Livio
- Bianchi Nicola
- Bianchin Chiara
- Bielčík Jaroslav
- Bielčíková Jana
- Bilandzic Ante
- Bimbot L.
- Biolcati E.
- Blanc A.
- Blanco Fernando
- Blanco Fernando
- Blau Dmitry S.
- Blume Christoph
- Boccioli M.
- Bock N.
- Bogdanov Alexey A.
- Bogolyubsky M.
- Bohm J.
- Boldizsár László
- Bombara Marek
- Bombonati C.
- Bondila M.
- Borel Hervé
- Borisov A.
- Bortolin C.
- Bose S.
- Bosisio L.
- Bossú Francesco
- Botje Michiel
- Bourdaud G.
- Boyer B.
- Braun M.
- Braun-Munzinger Peter
- Bravina L.
- Bregant Marco
- Breitner Timo
- Bruckner G.
- Brun René
- Bruna Elena
- Bruno Giuseppe Eugenio
- Budnikov Dmitry
- Bunčić Predrag
- Busch Oliver
- Buthelezi Edith Zinhle
- Bán J.
- Böttger Stefan
- Bøggild Hans
- Büsching Henner
- Caffarri Davide
- Cai Xiao
- Caines Helen Louise
- Calvo E.
- Camacho E.
- Camerini Paolo
- Campbell M.
- Canoa Roman V.
- Capitani G.P.
- Cara Romeo G.
- Carena Francesco
- Carena Wisla
- Carminati F.
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- Castillo Castellanos Javier Ernesto
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- Cattaruzza E.
- Cavicchioli Costanza
- Cerello Piergiorgio
- Chambert V.
- Chang B.
- Chapeland Sylvain
- Charpy A.
- Charvet Jean-Luc Fernand
- Chattopadhyay S.
- Chattopadhyay S.
- Cherney Michael Gerard
- Cheshkov Cvetan Valeriev
- Cheynis Brigitte
- Chiavassa E.
- Chibante Barroso Vasco Miguel
- Chinellato David Dobrigkeit
- Chochula Peter
- Choi Kyungeon
- Chojnacki Marek
- Christakoglou Panagiotis
- Christensen Christian Holm
- Christiansen Peter L.
- Chujo Tatsuya
- Chuman F.
- Cicalò Corrado
- Cifarelli Luisa
- Cindolo Federico
- Cleymans Jean Willy Andre
- Cobanoglu O.
- Coffin J.-P.
- Coli S.
- Colla A.
- Conesa Balbastre Gustavo
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- Conner E.S.
- Constantin P.
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- Contreras Nuno Jesus Guillermo
- Cormier Thomas Michael
- Corrales Morales Yasser
- Cortese Pietro
- Cortés Maldonado Ismael
- Cosentino Mauro Rogerio
- Costa Filippo
- Cotallo M.E.
- Crescio E.
- Crochet Philippe
- Cuautle Flores Eleazar
- Cunqueiro Mendez Leticia
- Cussonneau J.
- Cuveland Jan de
- Dainese Andrea
- Dalsgaard H.H.
- Danu Andrea
- Das Indranil
- Dash Ajay Kumar
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- De Caro Annalisa
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- de Groot J.
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- Dobrin Alexandru Florin
- Dobrowolski Tadeusz Antoni
- Domínguez I.
- Don D.M.M.
- Dordic Olja
- Dubey Anand Kumar
- Dubuisson J.
- Ducroux Laurent
- Dupieux Pascal
- Dutta Majumdar A.K.
- Dutta Majumdar M.R.
- Dénes Ervin Sandor
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- Dönigus Benjamin
- D’Erasmo Ginevra
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- Enokizono A.
- Espagnon Bruno
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- Evans David
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- Eyyubova Gyulnara
- Fabjan C.W.
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- Floris Michele
- Fodor Zoltán
- Foertsch Siegfried Valentin
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- Gorbunov Sergey
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- Gotovac Sven
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- Grabski Varlen
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- Grelli Alessandro
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- Gładysz-Dziaduś Ewa
- Haaland Øystein Senneset
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- Srivastava Brijesh Kumar
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- Stefanini G.
- Steinbeck T.
- Stenlund Evert Anders
- Steyn Gideon Francois
- Stocco Diego
- Stock Reinhard
- Stolpovsky P.
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- Suaide Alexandre Alarcon do Passo
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- Telesca Adriana
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- Torii H.
- Torralba G.
- Toscano L.
- Tosello F.
- Tournaire A.
- Traczyk T.
- Tribedy Prithwish
- Truesdale D.
- Trzaska Wladyslaw Henryk
- Tröger G.
- Tsiledakis G.
- Tsilis E.
- Tsuji Tomoya
- Tumkin Alexandr
- Turrisi Rosario
- Turvey A.
- Tveter Trine Spedstad
- Tydesjö H.
- Tywoniuk K.
- Ulery Jason Glyndwr
- Ullaland Kjetil
- Uras Antonio
- Urbán J.
- Urciuoli G.M.
- Usai Gianluca
- Vacchi A.
- Vala Martin
- Valencia Palomo Lizardo
- Vallero Sara
- Vannucci L.
- Vargas Treviño Maria Aurora Diozcora
- Varma Raghava
- Vasileiou Maria
- Vasiliev Andrey
- Vassiliev Iouri
- Vechernin Vladimir
- Venaruzzo Massimo
- Vercellin Ermanno
- Vergara S.
- Vernet Renaud
- Verweij Marta
- Vetlitskiy I.
- Vicković Linda
- Viesti Giuseppe
- Vikhlyantsev O.
- Vilakazi Zabulon
- Villalobos Baillie Orlando
- Vinogradov Alexander A.
- Vinogradov Leonid
- Vinogradov Yury I.
- Virgili Tiziano
- Viyogi Yogendra P.
- Vodopianov A.
- Voloshin Kirill
- Voloshin Sergei
- Volpe Giacomo
- Vranić Danilo
- Vrláková Janka
- Vulpescu Bogdan
- Vyvre Pierre vande
- Wagner Boris
- Wagner V.
- Wallet L.
- Wan R.
- Wang D.
- Wang Y.
- Wang Y.
- Watanabe K.
- Wen Q.
- Wessels J.
- Westerhoff Uwe
- Wiechula Jens
- Wikne Jon
- Wilk A.
- Wilk Grzegorz Andrzej
- Williams M. Crispin S.
- Willis N.
- Windelband Bernd
- Xu C.
- Yang C.
- Yang H.
- Yasnopolskiy S.
- Yermia F.
- Yi J.
- Yin Zhongbao
- Yokoyama Hiroki
- Yoo In-Kwon
- Yuan X.
- Yurevich V.
- Yushmanov Igor E.
- Zabrodin E.
- Zagreev B.
- Zalite A.
- Zampolli Chiara
- Zanevsky Yuri V.
- Zaporozhets Sergey
- Zarochentsev Andrey
- Zbroszczyk Hanna Paulina
- Zelnicek P.
- Zenin A.
- Zepeda A.
- Zgura I.
- Zhalov Mikhail
- Zhang X.
- Zhou D.
- Zhou S.
- Zhu J.
- Zichichi Antonino
- Zinchenko A.
- Zinovjev Gennady M.
- Zoccarato Y.
- Zycháček V.
- Zynovyev M.
- Závada Petr
- Äystö J.
- Österman L.
- Øvrebekk G.
- Šafařík Karel
- Šumbera Michal
- Šuša Tatjana
- Šándor Ladislav
- Publication venue
- Publication date
- 20/08/2010
- Field of study
The inclusive charged particle transverse momentum distribution is measured in proton–proton collisions at s=900 GeV at the LHC using the ALICE detector. The measurement is performed in the central pseudorapidity region (|η|<0.8) over the transverse momentum range 0.15<pT<10 GeV/c. The correlation between transverse momentum and particle multiplicity is also studied. Results are presented for inelastic (INEL) and non-single-diffractive (NSD) events. The average transverse momentum for |η|<0.8 is 〈pT〉INEL=0.483±0.001 (stat.)±0.007 (syst.) GeV/c and 〈pT〉NSD=0.489±0.001 (stat.)±0.007 (syst.) GeV/c, respectively. The data exhibit a slightly larger 〈pT〉 than measurements in wider pseudorapidity intervals. The results are compared to simulations with the Monte Carlo event generators PYTHIA and PHOJET