Electronic structure
- Stuffing Improves the Stability of Fullerenelike Boron Clusters
Dasari L. V. K. Prasad and Eluvathingal D. Jemmis
Phys. Rev. Lett. 100, 165504 (2008)
- Electron transfer and localization in endohedral metallofullerenes : Ab initio density functional theory calculations
Shenyuan Yang, Mina Yoon, Christian Hicke, Zhenyu Zhang, and Enge Wang
Phys. Rev. B 78, 115435 (2008)
- Theoretical study of the electronic structure of fullerene -cubane cocrystals
V. Zólyomi, J. Koltai, J. Kürti, and S. Pekker
Phys. Rev. B 78, 115405 (2008)
- Vibrational stability and electronic structure of a B80 fullerene
Tunna Baruah, Mark R. Pederson, and Rajendra R. Zope
Phys. Rev. B 78, 045408 (2008)
- Room-temperature dissociative hydrogen chemisorption on boron-doped fullerenes
Hoonkyung Lee, Jia Li, Gang Zhou, Wenhui Duan, Gunn Kim, and Jisoon Ihm
Phys. Rev. B 77, 235101 (2008)
- Face-centered-cubic B80 metal: Density functional theory calculations
Qing-Bo Yan, Qing-Rong Zheng, and Gang Su
Phys. Rev. B 77, 224106 (2008)
- Looking underneath fullerenes on Au(110): Formation of dimples in the substrate
M. Hinterstein, X. Torrelles, R. Felici, J. Rius, M. Huang, S. Fabris, H. Fuess, and M. Pedio
Phys. Rev. B 77, 153412 (2008)
- B80 Fullerene : An Ab Initio Prediction of Geometry, Stability, and Electronic Structure
Nevill Gonzalez Szwacki, Arta Sadrzadeh, and Boris I. Yakobson
Phys. Rev. Lett. 98, 166804 (2007)
- High-symmetry high-stability silicon fullerenes : A first-principles study
Aristides D. Zdetsis
Phys. Rev. B 76, 075402 (2007)
- Structural and electronic properties of the fullerene isomers of Si38 : A systematic theoretical study
Zacharias G. Fthenakis, Remco W. Havenith, Madhu Menon, and Patrick W. Fowler
Phys. Rev. B 75, 155435 (2007)
- Effect of encapsulated atoms on the electronic structure of the fullerene cage: A case study on La2@C78 and Ti2C2@C78 via ultraviolet photoelectron spectroscopy
Shojun Hino, Masayuki Kato, Daisuke Yoshimura, Hiroe Moribe, Hisashi Umemoto, Yasuhiro Ito, Toshiki Sugai, Hisanori Shinohara, Minoru Otani, Yoshihide Yoshimoto, and Susumu Okada
Phys. Rev. B 75, 125418 (2007)
- Formulation in terms of normalized propagators of a charge-dipole model enabling the calculation of the polarization properties of fullerenes and carbon nanotubes
A. Mayer
Phys. Rev. B 75, 045407 (2007)
- Boron nitride fullerene B36N36 doped with transition metal atoms: First-principles calculations
Ronaldo J. Batista, Mário S. Mazzoni, and Helio Chacham
Phys. Rev. B 75, 035417 (2007)
- First- and second-electron affinities of C60 and C70 isomers
Henning Zettergren, Manuel Alcamí, and Fernando Martín
Phys. Rev. A 76, 043205 (2007)
- Effect of symmetry on the electronic structure of spheroidal fullerenes in a weak uniform magnetic field
M. Pudlak, R. Pincak, and V. A. Osipov
Phys. Rev. A 75, 065201 (2007)
- Electronic structure of spheroidal fullerenes in a weak uniform magnetic field: A continuum field-theory model
M. Pudlak, R. Pincak, and V. A. Osipov
Phys. Rev. A 75, 025201 (2007)
- Low-energy electronic states in spheroidal fullerenes
M. Pudlak, R. Pincak, and V. A. Osipov
Phys. Rev. B 74, 235435 (2006)
- Electron -phonon coupling in halogen-doped carbon clathrates from first principles
F. Zipoli, M. Bernasconi, and G. Benedek
Phys. Rev. B 74, 205408 (2006)
- Electron -electron correlations in fullerene C60 probed by incoherent scattering of x rays
C. Petrillo, F. Sacchetti, A. Orecchini, R. De Renzi, and M. Ricco
Phys. Rev. B 74, 085404 (2006)
- Filling factor and electronic structure of Dy3N@C80 filled single-wall carbon nanotubes studied by photoemission spectroscopy
H. Shiozawa, H. Rauf, T. Pichler, M. Knupfer, M. Kalbac, S. Yang, L. Dunsch, B. Büchner, D. Batchelor, and H. Kataura
Phys. Rev. B 73, 205411 (2006)
- Electronic structure of pristine and potassium-doped Y@C82 metallofullerene
C. Ton-That, A. G. Shard, V. R. Dhanak, H. Shinohara, J. S. Bendall, and M. E. Welland
Phys. Rev. B 73, 205406 (2006)
- Adsorption of fullerenes Cn (n=32,36,40,44,48,60) on the GaAs(001)-c(4Ã4) reconstructed surface
Chenggang Zhou, Jinping Wu, Bo Han, Shujuan Yao, and Hansong Cheng
Phys. Rev. B 73, 195324 (2006)
- Photoemission and inverse photoemission study of the electronic structure of C60 fullerenes encapsulated in single-walled carbon nanotubes
H. Shiozawa, H. Ishii, H. Kihara, N. Sasaki, S. Nakamura, T. Yoshida, Y. Takayama, T. Miyahara, S. Suzuki, Y. Achiba, T. Kodama, M. Higashiguchi, X. Y. Chi, M. Nakatake, K. Shimada, H. Namatame, M. Taniguchi, and H. Kataura
Phys. Rev. B 73, 075406 (2006)
- Dynamical core-hole screening in the x-ray absorption spectra of graphite, C60 , and carbon nanotubes: A first-principles electronic structure study
O. Wessely, O. Eriksson, and M. I. Katsnelson
Phys. Rev. B 73, 075402 (2006)
- Fullerene in a Metal-Organic Matrix: Design of the Electronic Structure
S. Hamel, V. Timoshevskii, and M. Côté
Phys. Rev. Lett. 95, 146403 (2005)
- Direct Imaging of the Alkali Metal Site in K-Doped Fullerene Peapods
L. Guan, K. Suenaga, Z. Shi, Z. Gu, and S. Iijima
Phys. Rev. Lett. 94, 045502 (2005)
- Electronic structures of the pristine and K-intercalated Tm3 N@ C80 endohedral fullerenes
X. Liu, M. Krause, J. Wong, T. Pichler, L. Dunsch, and M. Knupfer
Phys. Rev. B 72, 085407 (2005)
- Real-space electronic-structure calculations with a time-saving double-grid technique
T. Ono and K. Hirose
Phys. Rev. B 72, 085115 (2005)
- ( C6 H5 )5 C60 H at Si (111) - (7 x 7) and Ag:Si (111) - (sqrt[3] x sqrt[3]) R30
M. A. Phillips, J. N. O’Shea, P. R. Birkett, J. Purton, H. W. Kroto, D. R. M. Walton, R. Taylor, and P. Moriarty
Phys. Rev. B 72, 075426 (2005)
- Hyperdiamond and hyperlonsdaleit: Possible crystalline phases of fullerene C28
G. Seifert, A. N. Enyashin, and T. Heine
Phys. Rev. B 72, 012102 (2005)
- Chemisorption of C28 fullerene on c (4 x 4) reconstructed GaAs(001) surface: A density functional theory study
S. Yao, C. Zhou, L. Ning, J. Wu, Z. Pi, H. Cheng, and Y. Jiang
Phys. Rev. B 71, 195316 (2005)
- Well-shielded cerium atoms: Electronic structure of adsorbed Ce@ C82 on Si surfaces
K. Schulte, L. Wang, P. J. Moriarty, J. Purton, S. Patel, H. Shinohara, M. Kanai, and T. J. S. Dennis
Phys. Rev. B 71, 115437 (2005)
- Stabilizing the silicon fullerene Si20 by thorium encapsulation
A. K. Singh, V. Kumar, and Y. Kawazoe
Phys. Rev. B 71, 115429 (2005)
- Optimally stuffed fullerene structures of silicon nanoclusters
J. Wang, X. Zhou, G. Wang, and J. Zhao
Phys. Rev. B 71, 113412 (2005)
- C60 single domain growth on indium phosphide and its reaction with atomic hydrogen
M. Eremtchenko, S. Döring, R. Temirov, and J. A. Schaefer
Phys. Rev. B 71, 045410 (2005)
- Density functional calculations for C60 peapods
O. Dubay and G. Kresse
Phys. Rev. B 70, 165424 (2004)
- Electron-phonon interactions in C28 -derived molecular solids
N. A. Romero, J. Kim, and R. M. Martin
Phys. Rev. B 70, 140504 (2004)
- Resolution of the binding configuration in nitrogen-doped carbon nanotubes
L. H. Chan, K. H. Hong, D. Q. Xiao, T. C. Lin, S. H. Lai, W. J. Hsieh, and H. C. Shih
Phys. Rev. B 70, 125408 (2004)
- Rigid crystalline phases of polymerized fullerenes
S. Berber, E. Osawa, and D. Tománek
Phys. Rev. B 70, 085417 (2004)
- Tantalum-fullerene clusters: A first-principles study of static properties and dynamical behavior
L. M. Ramaniah, M. Boero, and M. Laghate
Phys. Rev. B 70, 035411 (2004)
- Anomalous endohedral structure of Gd@C82 metallofullerenes
E. Nishibori, K. Iwata, M. Sakata, M. Takata, H. Tanaka, H. Kato, and H. Shinohara
Phys. Rev. B 69, 113412 (2004)
- Rotation, translation, charge transfer, and electronic structure of C60 on Cu(111) surface
L.-L. Wang and H.-P. Cheng
Phys. Rev. B 69, 045404 (2004)
- Pair-Ion Plasma Generation using Fullerenes
W. Oohara and R. Hatakeyama
Phys. Rev. Lett. 91, 205005 (2003)
- Resonant Electron Transfer in Collisions between Two Fullerene Ions
H. Bräuning, R. Trassl, A. Diehl, A. Theiß, E. Salzborn, A. A. Narits, and L. P. Presnyakov
Phys. Rev. Lett. 91, 168301 (2003)
- Orbital Hybridization and Charge Transfer in Carbon Nanopeapods
Y. Cho, S. Han, G. Kim, H. Lee, and J. Ihm
Phys. Rev. Lett. 90, 106402 (2003)
- Direct Imaging of Sc2@C84 Molecules Encapsulated Inside Single-Wall Carbon Nanotubes by High Resolution Electron Microscopy with Atomic Sensitivity
K. Suenaga, T. Okazaki, C.-R. Wang, S. Bandow, H. Shinohara, and S. Iijima
Phys. Rev. Lett. 90, 055506 (2003)
- Electronic structure and rebonding in the onionlike As@Ni12@As20 cluster
T. Baruah, R. R. Zope, S. L. Richardson, and M. R. Pederson
Phys. Rev. B 68, 241404 (2003)
- Electronic structures of fullerenes and metallofullerenes studied by surface potential analysis
M. Shiraishi, K. Shibata, R. Maruyama, and M. Ata
Phys. Rev. B 68, 235414 (2003)
- Jahn-Teller effects in the fullerene anion C2-60
S. Sookhun, J. L. Dunn, and C. A. Bates
Phys. Rev. B 68, 235403 (2003)
- Resonance and high-pressure Raman studies on carbon peapods
P. M. Rafailov, C. Thomsen, and H. Kataura
Phys. Rev. B 68, 193411 (2003)
- Ab initio calculations of electronic structures, polarizabilities, Raman and infrared spectra, optical gaps, and absorption spectra of M@Si16 (M=Ti and Zr) clusters
V. Kumar, T. M. Briere, and Y. Kawazoe
Phys. Rev. B 68, 155412 (2003)
- Energetics and electronic structures of one-dimensional fullerene chains encapsulated in zigzag nanotubes
M. Otani, S. Okada, and A. Oshiyama
Phys. Rev. B 68, 125424 (2003)
- Defective fullerenes and nanotubes as molecular magnets: An ab initio study
Y.-H. Kim, J. Choi, K. J. Chang, and D. Tománek
Phys. Rev. B 68, 125420 (2003)
- Strongly size-dependent electronic properties in C60-encapsulated zigzag nanotubes and lower size limit of carbon nanopeapods
J. Lu, S. Nagase, S. Zhang, and L. Peng
Phys. Rev. B 68, 121402 (2003)
- Field doping of C60 crystals: Polarization and Stark splitting
S. Wehrli, E. Koch, and M. Sigrist
Phys. Rev. B 68, 115412 (2003)
- Electron-state control of carbon nanotubes by space and encapsulated fullerenes
S. Okada, M. Otani, and A. Oshiyama
Phys. Rev. B 67, 205411 (2003)
- Polaron in a one-dimensional C60 crystal
V. R. Belosludov, T. M. Inerbaev, R. V. Belosludov, and Y. Kawazoe
Phys. Rev. B 67, 155410 (2003)
- Erratum: Electronic and transport properties of single-wall carbon nanotubes encapsulating fullerene-based structures [Phys. Rev. B 64, 115409 (2001)]
D.-H. Kim, H.-S. Sim, and K. J. Chang
Phys. Rev. B 67, 129903 (2003)
- Theoretical identification of C20 carbon clusters: Prevalence of the monocyclic isomer and existence of the smallest fullerene and bowl isomer
J. Lu, S. Re, Y.-k. Choe, S. Nagase, Y. Zhou, R. Han, L. Peng, X. Zhang, and X. Zhao
Phys. Rev. B 67, 125415 (2003)
- In situ growth and thermal treatment of nanostructured carbon produced by supersonic cluster beam deposition: An electron spectroscopy investigation
E. Magnano, C. Cepek, M. Sancrotti, F. Siviero, S. Vinati, C. Lenardi, P. Piseri, E. Barborini, and P. Milani
Phys. Rev. B 67, 125414 (2003)
- Structure and electronic states of capped carbon nanotubes by a tight-binding approach
Y. Kasahara, R. Tamura, and M. Tsukada
Phys. Rev. B 67, 115419 (2003)
- Photoemission spectroscopy of clean and potassium-intercalated carbon onions
M. Montalti, S. Krishnamurthy, Y. Chao, Yu. V. Butenko, V. L. Kuznetsov, V. R. Dhanak, M. R. C. Hunt, and L. Siller
Phys. Rev. B 67, 113401 (2003)
- Contrasting bonding behavior of thiol molecules on carbon fullerene structures
J. C. Mixteco-Sánchez and R. A. Guirado-López
Phys. Rev. A 68, 053204 (2003)
- Crystal structures and electronic properties of haloform-intercalated C60
R. Windiks, A. Bill, B. Delley, and V. Z. Kresin
Phys. Rev. B 66, 195418 (2002)
- Stability and electronic properties of Si-doped carbon fullerenes
R. Guirado-López
Phys. Rev. B 65, 165421 (2002)
- Raman study of the two-dimensional polymers Na4C60 and tetragonal C60
T. Wågberg and B. Sundqvist
Phys. Rev. B 65, 155421 (2002)
- Generating charge densities of fullerenes
L.-W. Wang
Phys. Rev. B 65, 153410 (2002)
- Mechanisms involved in the formation of onionlike carbon nanostructures synthesized by ion implantation at high temperature
Th. Cabioc
Phys. Rev. B 65, 132103 (2002)
- Si-C bonding in films prepared by heterofullerene deposition
P. Mélinon, X. Blase, P. Kéghélian, A. Perez, C. Ray, M. Pellarin, M. Broyer, and B. Champagnon
Phys. Rev. B 65, 125321 (2002)
- Filling factors, structural, and electronic properties of C60 molecules in single-wall carbon nanotubes
X. Liu, T. Pichler, M. Knupfer, M. S. Golden, J. Fink, H. Kataura, Y. Achiba, K. Hirahara, and S. Iijima
Phys. Rev. B 65, 045419 (2002)
- Electronic structure of periodic curved surfaces: Topological band structure
H. Aoki, M. Koshino, D. Takeda, H. Morise, and K. Kuroki
Phys. Rev. B 65, 035102 (2002)
- Three-dimensional crystalline carbon: Stable polymers of C20 fullerene
S. Okada, Y. Miyamoto, and M. Saito
Phys. Rev. B 64, 245405 (2001)
- Photoemission study of chemisorption of C60 on InP(100)
Y. Chao, K. Svensson, D. Radosavkic, V. R. Dhanak, L. Siller, and M. R. C. Hunt
Phys. Rev. B 64, 235331 (2001)
- Semiconducting form of the first-row elements: C60 chain encapsulated in BN nanotubes
S. Okada, S. Saito, and A. Oshiyama
Phys. Rev. B 64, 201303 (2001)
- Theoretical study of the structural and electronic properties of two-dimensionally polymerized fullerene clusters with 2, 3, 4, and 7 C60 molecules
J. M. Cabrera-Trujillo and J. Robles
Phys. Rev. B 64, 165408 (2001)
- Electronic structure, bonding nature, and charge transfer in Ba@Si20 and Si20 clusters: An ab initio study
T. Nagano, K. Tsumuraya, H. Eguchi, and D. J. Singh
Phys. Rev. B 64, 155403 (2001)
- Electron diffraction study of one-dimensional crystals of fullerenes
K. Hirahara, S. Bandow, K. Suenaga, H. Kato, T. Okazaki, H. Shinohara, and S. Iijima
Phys. Rev. B 64, 115420 (2001)
- Electronic and transport properties of single-wall carbon nanotubes encapsulating fullerene-based structures
D.-H. Kim, H.-S. Sim, and K. J. Chang
Phys. Rev. B 64, 115409 (2001)
- Electronic structure and optical properties of concentric-shell fullerenes from electron-energy-loss spectroscopy in transmission
T. Pichler, M. Knupfer, M. S. Golden, J. Fink, and T. Cabioc
Phys. Rev. B 63, 155415 (2001)
- Bond formation in titanium fulleride compounds studied through x-ray emission spectroscopy
M. Nyberg, Y. Luo, L. Qian, J.-E. Rubensson, C. Såthe, D. Ding, J.-H. Guo, T. Käämbre, and J. Nordgren
Phys. Rev. B 63, 115117 (2001)
- Ab initio study of silicon-multisubstituted neutral and charged fullerenes
C.-C. Fu, M. Weissmann, M. Machado, and P. Ordejón
Phys. Rev. B 63, 085411 (2001)
- Formation mechanism and structural and electronic properties of metal-substituted fullerenes C69M (M=Co, Rh, and Ir)
D. Changgeng, Y. Jinlong, H. Rongsheng, and W. Kelin
Phys. Rev. A 64, 043201 (2001)
- Spontaneous Formation and Stability of Small GaP Fullerenes
V. Tozzini, F. Buda, and A. Fasolino
Phys. Rev. Lett. 85, 4554 (2000)
- Structures and electronic properties of small carbon nanotube tori
D.-H. Oh, J. Mee Park, and K. S. Kim
Phys. Rev. B 62, 1600 (2000)
- Solid C36 as hexaclathrate form of carbon
M. Menon, E. Richter, and L. Chernozatonskii
Phys. Rev. B 62, 15420 (2000)
- Proof for trivalent Sc ions in Sc2@C84 from high-energy spectroscopy
T. Pichler, Z. Hu, C. Grazioli, S. Legner, M. Knupfer, M. S. Golden, J. Fink, F.M.F. de Groot, M.R.C. Hunt, P. Rudolf, R. Follath, Ch. Jung, L. Kjeldgaard, P. Brühwiler, M. Inakuma, and H. Shinohara
Phys. Rev. B 62, 13196 (2000)
- Electron-phonon interaction in C70
D. Provasi, N. Breda, R. A. Broglia, G. Colò, H. E. Roman, and G. Onida
Phys. Rev. B 61, 7775 (2000)
- Band gap of essentially fourfold-coordinated amorphous diamond synthesized from C60 fullerene
H. Hirai, M. Terauchi, M. Tanaka, and K. Kondo
Phys. Rev. B 60, 6357 (1999)
- Electron-beam-induced fragmentation in ultrathin C60 films on Si(100)-2 x 1-H: Mechanisms of cage destruction
M. R. C. Hunt, J. Schmidt, and R. E. Palmer
Phys. Rev. B 60, 5927 (1999)
- Structural and electronic properties of germanium clathrates Ge46 and K8Ge46
J. Zhao, A. Buldum, J. Ping Lu, and C. Y. Fong
Phys. Rev. B 60, 14177 (1999)
- Field-induced diffusion of gold and related phase transformations in the C60 and C70 fullerenes
L. Firlej, N. Kirova, and A. Zahab
Phys. Rev. B 59, 16028 (1999)
- Electron-Phonon Interactions in Solid C36
M. Côté, J. C. Grossman, M. L. Cohen, and S. G. Louie
Phys. Rev. Lett. 81, 697 (1998)
- Electronic Structure of Small Fullerenes: Evidence for the High Stability of C32
H. Kietzmann, R. Rochow, G. Ganteför, W. Eberhardt, K. Vietze, G. Seifert, and P. W. Fowler
Phys. Rev. Lett. 81, 5378 (1998)
- Electronic and structural properties of multiwall carbon nanotubes
Y.-K. Kwon and D. Tománek
Phys. Rev. B 58, R16001 (1998)
- Electronic structure of the singly bonded (C60)x fullerene polymer
P. R. Surján, A. Lázár, and M. Kállay
Phys. Rev. B 58, 3490 (1998)
- Possible high-pressure phase of diamond
S. Serra, G. Benedek, M. Facchinetti, and L. Miglio
Phys. Rev. B 57, 5661 (1998)
- On-Ball Doping of Fullerenes: The Electronic Structure of C59N Dimers from Experiment and Theory
T. Pichler, M. Knupfer, M. S. Golden, S. Haffner, R. Friedlein, J. Fink, W. Andreoni, A. Curioni, M. Keshavarz-K, C. Bellavia-Lund, A. Sastre, J.-C. Hummelen, and F. Wudl
Phys. Rev. Lett. 78, 4249 (1997)
- Intramolecular Charge Disproportionation and the Band Structure of A3C60 Superconductors
A. Ceulemans, L. F. Chibotaru, and F. Cimpoesu
Phys. Rev. Lett. 78, 3725 (1997)
- Coordination-number defects and ring formulation of fullerenelike clusters produced by C60-C60 collision
Y. Xia, Y. Mu, Y. Xing, C. Tan, and L. Mei
Phys. Rev. B 56, 4979 (1997)
- Electron-momentum spectroscopy of fullerene
M. Vos, S. A. Canney, I. E. McCarthy, S. Utteridge, M. T. Michalewicz, and E. Weigold
Phys. Rev. B 56, 1309 (1997)
- Photoemission and electron-energy-loss-spectroscopy study of C60 monolayers adsorbed on Cs-precovered Au(110) and of bulk distilled CsxC60
M. R. C. Hunt, P. Rudolf, and S. Modesti
Phys. Rev. B 55, 7889 (1997)
- Localization of substrate-induced modification in the electronic structureof C60sat fullerene-metal interfaces
M. R. C. Hunt, P. Rudolf, and S. Modesti
Phys. Rev. B 55, 7882 (1997)
- Dirac-Fock-Slater calculations on the geometric and electronic structure of neutral and multiply charged C60 fullerenes
T. Bastug, P. Kürpick, J. Meyer, W.‐D. Sepp, B. Fricke, and A. Rosén
Phys. Rev. B 55, 5015 (1997)
- Role of ambient gas on laser-ablated plumes for thin carbon film deposition
R. K. Thareja and R. K. Dwivedi
Phys. Rev. B 55, 2600 (1997)
- Freedom and Constraints of a Metal Atom Encapsulated in Fullerene Cages
W. Andreoni and A. Curioni
Phys. Rev. Lett. 77, 834 (1996)
- First Principles Study of a New Large-Gap Nonoporous Silicon Crystal: Hex-Si40
E. Galvani, G. Onida, S. Serra, and G. Benedek
Phys. Rev. Lett. 77, 3573 (1996)
- Symmetrized projector quantum Monte Carlo studies of the ground state of C60
B. Srinivasan, S. Ramasesha, and H. R. Krishnamurthy
Phys. Rev. B 54, 1692 (1996)
- Scanning tunneling microscopy of C60/Al(111)-6 x 6: Inequivalent molecular sites and electronic structures
M. K. ‐J. Johansson, A. J. Maxwell, S. M. Gray, P. A. Brühwiler, D. C. Mancini, L. S. O. Johansson, and N. Mårtensson
Phys. Rev. B 54, 13472 (1996)
- Electron-beam analysis of polymerized KC60
N. G. Chopra, J. Hone, and A. Zettl
Phys. Rev. B 53, 8155 (1996)
- Electronic structures of fullerenes Cn with Ih symmetry and n=20k2
A. C. Tang, F. Q. Huang, and R. Z. Liu
Phys. Rev. B 53, 7442 (1996)
- Structure and energetics of giant fullerenes: An order-N molecular-dynamics study
S. Itoh, P. Ordejón, D. A. Drabold, and R. M. Martin
Phys. Rev. B 53, 2132 (1996)
- Theoretical study of the binding of Na clusters encapsulated in the C240 fullerene
J. M. Cabrera
Phys. Rev. B 53, 16059 (1996)
- Collective excitations of multishell carbon microstructures: Multishell fullerenes and coaxial nanotubes
C. Yannouleas, E. N. Bogachek, and U. Landman
Phys. Rev. B 53, 10225 (1996)
- Interactions of the Na2 dimer with a C60 molecule
A. S. Hira and A. K. Ray
Phys. Rev. A 54, 2205 (1996)
- Common Electronic Structure and Pentagon Pairing in Extractable Fullerenes
S. Saito, S. Okada, S.-i. Sawada, and N. Hamada
Phys. Rev. Lett. 75, 685 (1995)
- Structure and Stability of Molecular Carbon: Importance of Electron Correlation
J. C. Grossman, L. Mitas, and K. Raghavachari
Phys. Rev. Lett. 75, 3870 (1995)
- Linear Scaling Method for Phonon Calculations from Electronic Structure
P. Ordejón, D. A. Drabold, R. M. Martin, and S. Itoh
Phys. Rev. Lett. 75, 1324 (1995)
- Fullerene Dimers: Cohesive Energy, Electronic Structure, and Vibrational Modes
M. R. Pederson and A. A. Quong
Phys. Rev. Lett. 74, 2319 (1995)
- C60 on Al(111): Covalent bonding and surface reconstruction
A. J. Maxwell, P. A. Brühwiler, S. Andersson, D. Arvanitis, B. Hernnäs, O. Karis, D. C. Mancini, N. Mårtensson, S. M. Gray, M. K. ‐J. Johansson, and L. S. O. Johansson
Phys. Rev. B 52, R5546 (1995)
- Radial distribution function of a new form of amorphous diamond shock induced from C60 fullerene
H. Hirai, Y. Tabira, K. Kondo, T. Oikawa, and N. Ishizawa
Phys. Rev. B 52, 6162 (1995)
- Structural and electronic properties of polymeric fullerene chains
M. Springborg
Phys. Rev. B 52, 2935 (1995)
- Theoretical study of cubic structures based on fullerene carbon clusters: C28C and (C28)2
L. M. Zeger, Y. Juan, E. Kaxiras, and A. Antonelli
Phys. Rev. B 52, 2125 (1995)
- Electronic structures of C60 and C70 adsorbed on the Cu(111) surface and intramolecular STM images
Y. Maruyama, K. Ohno, and Y. Kawazoe
Phys. Rev. B 52, 2070 (1995)
- Theoretical studies of multishell fullerenes
A. C. Tang and F. Q. Huang
Phys. Rev. B 52, 17435 (1995)
- Fullerene nanotubes in electric fields
L. Lou, P. Nordlander, and R. E. Smalley
Phys. Rev. B 52, 1429 (1995)
- First-principles calculation of the electronic and optical properties of the organic superconductor kappa -(BEDT-TTF)2Cu(NCS)2
Y. Xu, W. Y. Ching, Y. C. Jean, and Y. Lou
Phys. Rev. B 52, 12946 (1995)
- Thermal decomposition of a fullerene mix
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