Symmetrization of atomic forces within the full-potential linearized augmented-plane-wave method

A. Di Pomponio; A. Continenza; R. Podloucky; J. Vackář

doi:10.1103/physrevb.53.9505

Symmetrization of atomic forces within the full-potential linearized augmented-plane-wave method

Physical Review B ◽

10.1103/physrevb.53.9505 ◽

1996 ◽

Vol 53 (15) ◽

pp. 9505-9508 ◽

Cited By ~ 15

Author(s):

A. Di Pomponio ◽

A. Continenza ◽

R. Podloucky ◽

J. Vackář

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Ab initio treatment of noncollinear magnets with the full-potential linearized augmented plane wave method

Physical Review B ◽

10.1103/physrevb.69.024415 ◽

2004 ◽

Vol 69 (2) ◽

Cited By ~ 136

Author(s):

Ph. Kurz ◽

F. Förster ◽

L. Nordström ◽

G. Bihlmayer ◽

S. Blügel

Keyword(s):

Plane Wave ◽

Ab Initio ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Surface calculations with asymptotically long-ranged potentials in the full-potential linearized augmented plane-wave method

Physical Review B ◽

10.1103/physrevb.92.115132 ◽

2015 ◽

Vol 92 (11) ◽

Cited By ~ 7

Author(s):

Lin-Hui Ye

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Full-potential linearized augmented plane-wave method for one-dimensional systems: Gold nanowire and iron monowires in a gold tube

Physical Review B ◽

10.1103/physrevb.72.045402 ◽

2005 ◽

Vol 72 (4) ◽

Cited By ~ 47

Author(s):

Y. Mokrousov ◽

G. Bihlmayer ◽

S. Blügel

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Gold Nanowire ◽

Augmented Plane Wave ◽

One Dimensional ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Calibration of the isomer shift for the14.4−keVtransition inFe57using the full-potential linearized augmented plane-wave method

Physical Review B ◽

10.1103/physrevb.76.155118 ◽

2007 ◽

Vol 76 (15) ◽

Cited By ~ 68

Author(s):

U. D. Wdowik ◽

K. Ruebenbauer

Keyword(s):

Plane Wave ◽

Isomer Shift ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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First principle study on the possibilities of magnetism in one-dimensional In and Tl atomic wires with the full-potential linearized augmented plane wave method

Acta Metallurgica Sinica (English Letters) ◽

10.1016/s1006-7191(08)60078-2 ◽

2009 ◽

Vol 22 (2) ◽

pp. 117-122 ◽

Cited By ~ 1

Author(s):

Zhili ZHU ◽

Jinhua GU ◽

Yu JIA ◽

Xing HU

Keyword(s):

Plane Wave ◽

Full Potential ◽

First Principle ◽

Wave Method ◽

Augmented Plane Wave ◽

One Dimensional ◽

Plane Wave Method ◽

Atomic Wires ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Energy band structure of LaCuOCh (Ch = S, Se and Te) calculated by the full-potential linearized augmented plane-wave method

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/16/28/036 ◽

2004 ◽

Vol 16 (28) ◽

pp. 5179-5186 ◽

Cited By ~ 45

Author(s):

Kazushige Ueda ◽

Hideo Hosono ◽

Noriaki Hamada

Keyword(s):

Band Structure ◽

Plane Wave ◽

Energy Band ◽

Energy Band Structure ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Stress Formulation in the All-Electron Full-Potential Linearized Augmented Plane Wave Method: II. Accuracy Check in the Generalized Gradient Approximation

Journal of the Physical Society of Japan ◽

10.7566/jpsj.82.044701 ◽

2013 ◽

Vol 82 (4) ◽

pp. 044701

Author(s):

Naoyuki Nagasako ◽

Tamio Oguchi

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Generalized Gradient ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Generalized Gradient Approximation ◽

Augmented Plane Wave Method ◽

Accuracy Check ◽

Linearized Augmented Plane Wave

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Investigation of the optical properties of P, As and Sb incorporated AlGaX alloys using full potential linearized augmented plane wave method

Computer Physics Communications ◽

10.1016/j.cpc.2014.06.024 ◽

2014 ◽

Vol 185 (11) ◽

pp. 2829-2833 ◽

Cited By ~ 6

Author(s):

Iftikhar Ahmad ◽

Muhammad Maqbool

Keyword(s):

Optical Properties ◽

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Magnetism of hexagonal close-packed nickel calculated by full-potential linearized augmented plane wave method

Journal of Magnetism and Magnetic Materials ◽

10.1016/j.jmmm.2015.02.024 ◽

2015 ◽

Vol 384 ◽

pp. 49-51 ◽

Cited By ~ 1

Author(s):

F. Tian ◽

H. Tian ◽

L. Whitmore ◽

L.Y. Ye

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Hexagonal Close Packed ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

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Stress Formulation in the All-Electron Full-Potential Linearized Augmented Plane Wave Method

Journal of the Physical Society of Japan ◽

10.1143/jpsj.80.024701 ◽

2011 ◽

Vol 80 (2) ◽

pp. 024701 ◽

Cited By ~ 4

Author(s):

Naoyuki Nagasako ◽

Tamio Oguchi

Keyword(s):

Plane Wave ◽

Full Potential ◽

Wave Method ◽

Augmented Plane Wave ◽

Plane Wave Method ◽

Augmented Plane Wave Method ◽

Linearized Augmented Plane Wave

Download Full-text