Works matching DE "SELF-consistent field theory"

Results: 594

Composite Fayalite with 5% Laterite Soil and Iron Sand: Structural Properties and Band Gap Calculation Based on Theoretical Kubelka–Munk, Taylor Expansion, and Self-Consistent Field Method.

Published in:

JOM: The Journal of The Minerals, Metals & Materials Society (TMS), 2023, v. 75, n. 12, p. 5264, doi. 10.1007/s11837-023-05828-0

By:

Heryanto, Heryanto;
Tahir, Dahlang

Publication type:

Article

Tunable helical structures formed by blending ABC triblock copolymers and C homopolymers in nanopores.

Published in:

Polymer International, 2022, v. 71, n. 4, p. 444, doi. 10.1002/pi.6253

By:

Chen, Ka;
Wang, Feng;
Liu, Meijiao;
Wang, Xinping

Publication type:

Article

Self‐assembled nanostructures of diblock copolymer films under homopolymer topcoats.

Published in:

Polymer International, 2020, v. 69, n. 8, p. 728, doi. 10.1002/pi.6009

By:

Ji, Siyu;
Zhang, Runrong;
Zhang, Liangshun;
Yuan, Yuan;
Lin, Jiaping

Publication type:

Article

Multiconfiguration Pair-Density Functional Theory for Transition Metal Silicide Bond Dissociation Energies, Bond Lengths, and State Orderings.

Published in:

Molecules, 2021, v. 26, n. 10, p. 2881, doi. 10.3390/molecules26102881

By:

Oakley, Meagan S.;
Gagliardi, Laura;
Truhlar, Donald G.;
Gatti, Carlo;
Kuznetsov, Maxim L.;
Cooper, David L.;
Kohout, Miroslav

Publication type:

Article

An Overview of Self-Consistent Field Calculations Within Finite Basis Sets †.

Published in:

Molecules, 2020, v. 25, n. 5, p. 1218, doi. 10.3390/molecules25051218

By:

Lehtola, Susi;
Blockhuys, Frank;
Van Alsenoy, Christian;
Mosquera, Ricardo

Publication type:

Article

Full-Dimensional Ab Initio Potential Energy Surface and Vibrational Energy Levels of Li2H.

Published in:

Molecules, 2019, v. 24, n. 1, p. 26, doi. 10.3390/molecules24010026

By:

Ahn Furudate, Michiko;
Hagebaum-Reignier, Denis;
Jeung, Gwang-Hi

Publication type:

Article

Assessment of the Potential Energy Hypersurfaces in Thymine within Multiconfigurational Theory: CASSCF vs. CASPT2.

Published in:

Molecules, 2016, v. 21, n. 12, p. 1666, doi. 10.3390/molecules21121666

By:

Segarra-Martí, Javier;
Francés-Monerris, Antonio;
Roca-Sanjuán, Daniel;
Merchán, Manuela

Publication type:

Article

The Impact of Solvent Polarity on the Stability, Electronic Properties, and 1H NMR Chemical Shift of the Conformers of 2-Chloro-3-Methylcyclohexan-1-One Oxime: a Conceptual DFT Approach.

Published in:

Journal of Applied Spectroscopy, 2020, v. 86, n. 6, p. 1123, doi. 10.1007/s10812-020-00949-9

By:

Milani, N. N.;
Ghiasi, R.;
Forghaniha, A.

Publication type:

Article

Influence of Solvent and Electric Field on the Structure and IR, 31P NMR Spectroscopic Properties of a Titanocene-Benzyne Complex.

Published in:

Journal of Applied Spectroscopy, 2018, v. 85, n. 3, p. 526, doi. 10.1007/s10812-018-0683-8

By:

Rezazadeh, M.;
Ghiasi, R.;
Jamehbozorgi, S.

Publication type:

Article

Hartree-Fock self-consistent field method for atoms with two open shells of identical symmetry.

Published in:

Journal of Applied Spectroscopy, 2011, v. 77, n. 6, p. 741, doi. 10.1007/s10812-011-9397-x

By:

Malykhanov, Yu.;
Evseev, S.;
Eryomkin, I.

Publication type:

Article

De Sitter Model in the Presence of Scalar Fields. III. (comparison of the accelerated expansion of a model universe in various JBD representations).

Published in:

Astrophysics, 2014, v. 57, n. 2, p. 304, doi. 10.1007/s10511-014-9336-7

By:

Avagyan, R.;
Harutyunyan, G.;
Hovsepyan, A.;
Kotanjyan, A.

Publication type:

Article

Multireference Perturbation Theory Assessment of Electronic structure, and Reactivity for Iron-Doped Gold Clusters.

Published in:

Journals Kufa for Chamical, 2023, v. 3, n. 1, p. 288, doi. 10.36329/jkcm/2023/v3.i1.12067

By:

Almansori, Ali K.;
Abd-Suhail, Falah S.

Publication type:

Article

Prescott Lecky: Pioneer in consistency theory and cognitive therapy.

Published in:

Journal of Clinical Psychology, 1992, v. 48, n. 6, p. 807, doi. 10.1002/1097-4679(199211)48:6<807::AID-JCLP2270480615>3.0.CO;2-C

By:

Stevens, Michael J.

Publication type:

Article

Forcing broken symmetry to recover static electronic correlation: the H2 molecule test case.

Published in:

Physics & Chemistry of Liquids, 2024, v. 62, n. 2, p. 73, doi. 10.1080/00319104.2024.2326118

By:

Amovilli, Claudio

Publication type:

Article

Self-consistent modeling of radio-frequency plasma generation in stellarators.

Published in:

Plasma Physics Reports, 2013, v. 39, n. 11, p. 873, doi. 10.1134/S1063780X1311007X

By:

Moiseenko, V. E.;
Stadnik, Yu. S.;
Lysoivan, A. I.;
Korovin, V. B.

Publication type:

Article

Nonlinear modulation of an extraordinary wave under the conditions of parametric decay.

Published in:

Plasma Physics Reports, 2012, v. 38, n. 6, p. 466, doi. 10.1134/S1063780X12050030

By:

Dorofeenko, V.;
Krasovitskiy, V.;
Turikov, V.

Publication type:

Article

Specific features of the current-voltage characteristics of diffuse glow discharges in Ar:N mixtures.

Published in:

Plasma Physics Reports, 2010, v. 36, n. 12, p. 1040, doi. 10.1134/S1063780X10120056

By:

Dyatko, N.;
Ionikh, Yu.;
Meshchanov, A.;
Napartovich, A.;
Barzilovich, K.

Publication type:

Article

Current Sheet in a non-Maxwellian collisionless plasma: Self-consistent theory, simulation, and comparison with spacecraft observations.

Published in:

Plasma Physics Reports, 2010, v. 36, n. 10, p. 841, doi. 10.1134/S1063780X10100028

By:

Malova, Kh. V.;
Zelenyi, L. M.;
Mingalev, O. V.;
Mingalev, I. V.;
Popov, V. Yu.;
Artemyev, A. V.;
Petrukovich, A. A.

Publication type:

Article

Self-Consistent Quasineutral Dust Structures.

Published in:

Plasma Physics Reports, 2005, v. 31, n. 2, p. 133, doi. 10.1134/1.1866596

By:

Tsytovich, V.N.

Publication type:

Article

Formation and Development of a Leader Channel in Air.

Published in:

Plasma Physics Reports, 2003, v. 29, n. 8, p. 695, doi. 10.1134/1.1601648

By:

Popov, N.A.

Publication type:

Article

The Structure of Electronic States and Optical Properties of Cr80Al20 Compound.

Published in:

Optics & Spectroscopy, 2018, v. 125, n. 2, p. 195, doi. 10.1134/S0030400X18080131

By:

Knyazev, Yu. V.;
Lukoyanov, A. V.;
Kuzmin, Yu. I.;
Vasundhara, M.

Publication type:

Article

Electronic structure and optical spectroscopy of the GdRhGe compound.

Published in:

Optics & Spectroscopy, 2017, v. 122, n. 4, p. 574, doi. 10.1134/S0030400X17040154

By:

Lukoyanov, A.;
Knyazev, Yu.;
Kuz'min, Yu.;
Gupta, S.;
Suresh, K.

Publication type:

Article

A 340-400 GHz Zero-Biased Waveguide Detector Using an Self-Consistent Method to Extract the Parameters of Schottky Barrier Diode.

Published in:

Applied Computational Electromagnetics Society Journal, 2015, v. 30, n. 12, p. 1334

By:

Tianhao Ren;
Yong Zhang;
Ruimin Xu;
Jingtao Zhou;
Chengyue Yang;
Zhi Jin

Publication type:

Article

Forming of Ultrashort Electromagnetic Clusters by Two-Stream Superheterodyne Free Electron Lasers.

Published in:

Acta Physica Polonica: A, 2017, v. 131, n. 2, p. 213, doi. 10.12693/APhysPolA.131.213

By:

KULISH, V. V.;
LYSENKO, A. V.;
ROMBOVSKY, M. YU.;
KOVAL, V. V.;
VOLK, I. I.

Publication type:

Article

Host-Guest Self-assembly in Block Copolymer Blends.

Published in:

Scientific Reports, 2013, p. 1, doi. 10.1038/srep03190

By:

Woon Ik Park;
YongJoo Kim;
Jae Won Jeong;
Kyungho Kim;
Jung-Keun Yoo;
Yoon Hyung Hur;
Jong Min Kim;
Thomas, Edwin L.;
Alexander-Katz, Alfredo;
Yeon Sik Jung

Publication type:

Article

Polymer translocation through a hairy channel mimicking the inner plug of a nuclear pore complex.

Published in:

European Biophysics Journal, 2019, v. 48, n. 4, p. 317, doi. 10.1007/s00249-019-01356-5

By:

Zhang, Chibin;
Cheng, Zhiwei;
Lin, Xiaohui;
Chu, Wenquan

Publication type:

Article

QUANTUM HYDRODYNAMICS WITH NONLINEAR INTERACTIONS.

Published in:

Discrete & Continuous Dynamical Systems - Series S, 2016, v. 9, n. 1, p. 1, doi. 10.3934/dcdss.2016.9.1

By:

ANTONELLI, PAOLO;
MAROATI, PIERANGELO

Publication type:

Article

Size effect of the silicon carbide Young's modulus.

Published in:

Physica Status Solidi. A: Applications & Materials Science, 2017, v. 214, n. 4, p. n/a, doi. 10.1002/pssa.201600390

By:

Hähnlein, Bernd;
Kovac, Jaroslav;
Pezoldt, Jörg

Publication type:

Article

Crossing of the πd5/2 and πg7/2 orbitals in the 51Sb isotopes.

Published in:

European Physical Journal A -- Hadrons & Nuclei, 2005, v. 25, n. 3, p. 319, doi. 10.1140/epja/i2005-10137-8

By:

Porquet, M.-G;
Péru, S.;
Girod, M.

Publication type:

Article

Spherical Hartree-Fock calculations with linear-momentum projection before the variation: Part I: Energies, form factors, charge densities and mathematical sum rules.

Published in:

European Physical Journal A -- Hadrons & Nuclei, 2004, v. 19, n. 1, p. 45, doi. 10.1140/epja/i2003-10108-1

By:

Rodríguez-Guzmán, R. R.;
Schmid, K. W.

Publication type:

Article

An Investigation into the Self-Consistency of Raters: The Case of a High-Stakes National Level Examination in Pakistan.

Published in:

Kashmir Journal of Language Research, 2017, v. 20, n. 1, p. 223

By:

Munir, Athar;
Bukhari, Nadeem Haider

Publication type:

Article

A comprehensive model of soft interactions in the LHC era.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2015, v. 30, n. 8, p. -1, doi. 10.1142/S0217751X15420051

By:

Gotsman, Errol;
Levin, Eugene;
Maor, Uri

Publication type:

Article

OCTONION ELECTRODYNAMICS IN ISOTROPIC AND CHIRAL MEDIUM.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2014, v. 29, n. 2, p. -1, doi. 10.1142/S0217751X14500080

By:

CHANYAL, B. C.;
BISHT, P. S.;
NEGI, O. P. S.

Publication type:

Article

A SELF-CONSISTENT MODEL OF THE BLACK HOLE EVAPORATION.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2013, v. 28, n. 14, p. 1, doi. 10.1142/S0217751X13500504

By:

KAWAI, HIKARU;
MATSUO, YOSHINORI;
YOKOKURA, YUKI

Publication type:

Article

D-TERM DYNAMICAL SUPERSYMMETRY BREAKING GENERATING SPLIT N = 2 GAUGINO MASSES OF MIXED MAJORANA-DIRAC TYPE.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2012, v. 27, n. 26, p. 1, doi. 10.1142/S0217751X1250159X

By:

ITOYAMA, H.;
MARU, NOBUHITO

Publication type:

Article

GRAPH-THEORY INDUCED GRAVITY AND STRONGLY-DEGENERATE FERMIONS IN A SELF-CONSISTENT EINSTEIN UNIVERSE.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2012, v. 27, n. 23, p. 1, doi. 10.1142/S0217751X1250131X

By:

KAN, NAHOMI;
KOBAYASHI, KOICHIRO;
SHIRAISHI, KIYOSHI

Publication type:

Article

NONEQUILIBRIUM THERMO FIELD DYNAMICS FOR RELATIVISTIC COMPLEX SCALAR AND DIRAC FIELDS.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2012, v. 27, n. 14, p. 1250078-1, doi. 10.1142/S0217751X12500789

By:

MIZUTANI, YUICHI;
INAGAKI, TOMOHIRO

Publication type:

Article

A NEW DESCRIPTION OF MOTION OF THE FERMIONIC SO(2N+2) TOP IN THE CLASSICAL LIMIT UNDER THE QUASI-ANTICOMMUTATION RELATION APPROXIMATION.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2012, v. 27, n. 10, p. 1250054-1, doi. 10.1142/S0217751X12500546

By:

NISHIYAMA, SEIYA;
DA PROVIDÊNCIA, JOÃO;
PROVIDÊNCIA, CONSTANÇA

Publication type:

Article

THE PROPERTIES OF THE ${\bar K}^*$ MESON IN DENSE MATTER.

Published in:

International Journal of Modern Physics A: Particles & Fields; Gravitation; Cosmology; Nuclear Physics, 2011, v. 26, n. 3/4, p. 731, doi. 10.1142/S0217751X11052670

By:

MOLINA, R.;
TOLÓS, L.;
OSET, E.;
RAMOS, A.

Publication type:

Article

Theoretical study of low-lying electronic states spectra and transition properties of BeS molecule.

Published in:

Canadian Journal of Physics, 2024, v. 102, n. 9, p. 453, doi. 10.1139/cjp-2023-0343

By:

Sun, Shan;
Gao, Yufeng;
Zhu, Zunlue

Publication type:

Article

Flexible equation of state for a hard sphere and Lennard-Jones fluid near critical temperature.

Published in:

Pramana: Journal of Physics, 2014, v. 83, n. 6, p. 955, doi. 10.1007/s12043-014-0825-3

By:

KHASARE, S

Publication type:

Article

Thermodynamic Description of Al-Si-Mg-Ce Quaternary System in Al-Rich Corner and Its Experimental Validation.

Published in:

Journal of Phase Equilibria & Diffusion, 2018, v. 39, n. 1, p. 57, doi. 10.1007/s11669-017-0607-y

By:

Lu, Zhao;
Li, Xi;
Zhang, Lijun

Publication type:

Article

New Thermodynamic Assessment of the Fe-Y System.

Published in:

Journal of Phase Equilibria & Diffusion, 2017, v. 38, n. 5, p. 684, doi. 10.1007/s11669-017-0574-3

By:

Saenko, I.;
Fabrichnaya, O.;
Udovsky, A.

Publication type:

Article

An Updated Thermodynamic Modeling of the Al-Zr System.

Published in:

Journal of Phase Equilibria & Diffusion, 2015, v. 36, n. 5, p. 404, doi. 10.1007/s11669-015-0398-y

By:

Fischer, Evelyne;
Colinet, Catherine

Publication type:

Article

Regularization Inverse Method for Variable Binary Diffusivity Measurements.

Published in:

Journal of Phase Equilibria & Diffusion, 2012, v. 33, n. 3, p. 195, doi. 10.1007/s11669-012-0031-2

By:

Jaques, Alonso;
LaCombe, Jeffrey

Publication type:

Article

Star Brushes Under Deformation: Structure and Thermodynamics.

Published in:

Macromolecular Symposia, 2015, v. 348, n. 1, p. 33, doi. 10.1002/masy.201450175

By:

Polotsky, Alexey A.;
Misorin, Alexey K.;
Zhulina, Ekaterina B.;
Birshtein, Tatiana M.

Publication type:

Article

Effect of mutation on the stabilization energy of HIV-1 zinc fingers: a hybrid local self-consistent field/molecular mechanics investigation.

Published in:

Journal of Biological Inorganic Chemistry (JBIC), 2017, v. 22, n. 1, p. 109, doi. 10.1007/s00775-016-1411-6

By:

Drici, Nedjoua;
Krallafa, Mohamed

Publication type:

Article

Calculation of DC Stark Resonances for the Ammonia Molecule.

Published in:

Molecules, 2024, v. 29, n. 7, p. 1543, doi. 10.3390/molecules29071543

By:

Pirkola, Patrik;
Horbatsch, Marko

Publication type:

Article

Theoretical Study of Phase Behaviors of Symmetric Linear B 1 A 1 B 2 A 2 B 3 Pentablock Copolymer.

Published in:

Molecules, 2023, v. 28, n. 8, p. 3536, doi. 10.3390/molecules28083536

By:

Zhao, Bin;
Dong, Qingshu;
Yang, Wei;
Xu, Yuci

Publication type:

Article

Equilibrium shapes of a drop pendant in an electrostatic field.

Published in:

Fluid Dynamics, 2012, v. 47, n. 5, p. 575, doi. 10.1134/S0015462812050031

By:

Mogilevskii, E.;
Shkadov, V.;
Shutov, A.

Publication type:

Article