A. Dixit

发表

Bridging molecular dynamics and correlated wave-function methods for accurate finite-temperature properties

S. Lebègue, T. Gould, M. Badawi, 2019, Physical Review Materials.

Structural, electronic, elastic, vibrational and thermodynamic properties of antiperovskites Mg3NX (X = Ge, Sn): A DFT study

R. Sharma, A. Mishra, A. Dixit, 2022, Physics Letters A.

Structural, elastic, mechanical, and thermodynamic characteristic of NaReO3 and KReO3 perovskite oxides from first principles study

R. Sharma, R. Khenata, A. Dixit, 2022, The European Physical Journal Plus.

Ab initio calculations of X-ray magnetic circular dichroism spectra within the projector augmented wave method: An implementation into the VASP code

Anant Dixit, M. Alouani, M. Alouani, 2016, Comput. Phys. Commun..

Relativistic effects : applications to multiferroic materials

A. Dixit, 2015 .

Lagrangian approach to the semirelativistic electron dynamics in the mean-field approximation

G. Manfredi, A. Dixit, J. Zamanian, 2013, 1403.3854.

Classical description of low energy16O +16O collisions

A. Dixit, V. Ramamurthy, Y. Waghmare, 1983 .

Effect of site disorder on the electronic, magnetic, and ferroelectric properties of gallium ferrite

M. Alouani, D. Stoeffler, A. Dixit, 2020 .

Benchmarking several van der Waals dispersion approaches for the description of intermolecular interactions.

S. Lebègue, T. Gould, D. Rocca, 2018, The Journal of chemical physics.

Probing a Device's Active Atoms

D. Lacour, M. Alouani, E. Beaurepaire, 2017, Advanced materials.

Methods for converging correlation energies within the dielectric matrix formalism

S. Lebègue, T. Gould, D. Rocca, 2018 .

Improving the Efficiency of Beyond-RPA Methods within the Dielectric Matrix Formulation: Algorithms and Applications to the A24 and S22 Test Sets.

Dario Rocca, Anant Dixit, Julien Claudot, 2017, Journal of chemical theory and computation.

Improving the accuracy of ground-state correlation energies within a plane-wave basis set: The electron-hole exchange kernel.

J. Ángyán, D. Rocca, A. Dixit, 2016, The Journal of chemical physics.

Communication: A novel implementation to compute MP2 correlation energies without basis set superposition errors and complete basis set extrapolation.

S. Lebègue, D. Rocca, A. Dixit, 2017, The Journal of chemical physics.

Spin-phonon-charge coupling in the two-dimensional honeycomb lattice compound Ni2Te3

H. D. Yang, A. Pal, T. Yen, 2023, Physical Review B.