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S. R. Barman

Publications and source records attributed to S. R. Barman.

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Scanning tunneling microscopy study of Ni2MnGa(100) surface

Ni2MnGa(100) surface has been investigated in the premartensite and martensite phase by using scanning tunneling microscopy. The presence of twined morphology is observed in the premartensite phase for Mn excess surface which exhibit non-equispaced parallel bands in one side of the twin boundary. Moreover, in the flat region of the surface two domains of non-periodic parallel bands corresponding to the incommensurate CDW is observed. Although, stoichiometric surface also exhibit twining but the parallel bands are equispaced and have equal corrugation. Most interestingly, coexistence of twined morphology and the CDW pattern is observed in the premartensite phase for Ni excess surface which was not reported till date. In the martensite phase for Mn excess surface, incommensurate CDW is transformed to commensurate CDW corresponding to the equispaced parallel bands. In stark contrast, stoichiometric surface exhibit parallel bands that have different periodicity in different regions. Both the voltage dependent STM and STS measurement establishes that this morphology is also related to the CDW.

cond-mat.mtrl-sci

Co$_{2}$PtGa: A promising magnetic shape memory alloy with high martensite transition temperature

In the present work, a combined theoretical and experimental study on Co$_{2}$PtGa Heusler alloy shows that it exhibits a martensite transition around 1320 K with a small thermal hysteresis (10 K). Dynamical stability of Co$_2$PtGa in the tetragonal phase has been established by the theoretically calculated phonon dispersion curves. Magnetization measurements suggest that this alloy is a ferromagnetic material with a saturation magnetic moment of 2.83 $μ_B$/f.u. at 2 K, which is in excellent agreement with the value obtained from \textit{ab-initio} calculations (2.87 $μ_B$/f.u.). Our present study demonstrates that Co$_{2}$PtGa is a promising material for high temperature magnetic shape memory application.

cond-mat.mtrl-sci

Premartensite to martensite transition and its implications on the origin of modulation in Ni2MnGa ferromagnetic shape memory alloy

We present here results of temperature dependent high resolution synchrotron x-ray powder diffraction study of sequence of phase transitions in Ni2MnGa. Our results show that the incommensurate martensite phase results from the incommensurate premartensite phase, and not from the austenite phase assumed in the adaptive phase model. The premartensite phase transforms to the martensite phase through a first order phase transition with coexistence of the two phases in a broad temperature interval (~40K), discontinuous change in the unit cell volume as also in the modulation wave vector across the transition temperature and considerable thermal hysteresis in the characteristic transition temperatures. The temperature variation of the modulation wave vector q shows smooth analytic behaviour with no evidence for any devilish plateau corresponding to an intermediate or ground state commensurate lock-in phases. The existence of the incommensurate 7M like modulated structure down to 5K suggests that the incommensurate 7M like modulation is the ground state of Ni2MnGa and not the Bain distorted tetragonal L10 phase or any other lock-in phase with a commensurate modulation. These findings can be explained within the framework of the soft phonon model.

cond-mat.mtrl-sci

Residual stress induced stabilization of martensite phase and its effect on the magneto-structural transition in Mn rich Ni-Mn-In/Ga magnetic shape memory alloys

The irreversibility of the martensite transition in magnetic shape memory alloys (MSMAs) with respect to external magnetic field is one of the biggest challenges that limits their application as giant caloric materials. This transition is a magneto-structural transition that is accompanied with a steep drop in magnetization (i.e., 'delta M') around the martensite start temperature (Ms) due to the lower magnetization of the martensite phase. In this communication, we show that 'delta M' around Ms in Mn rich Ni-Mn based MSMAs gets suppressed by two orders of magnitude in crushed powders due to the stabilization of the martensite phase at temperatures well above the Ms and the austenite finish (Af) temperatures due to residual stresses. Analysis of the intensities and the FWHM of the x-ray powder diffraction patterns reveals stabilized martensite phase fractions as 97, 75 and 90% with corresponding residual microstrains as 5.4, 5.6 and 3% in crushed powders of the three different Mn rich Ni-Mn alloys, namely, Mn1.8Ni1.8In0.4, Mn1.75Ni1.25Ga and Mn1.9Ni1.1Ga, respectively. Even after annealing at 773 K, the residual stress stabilised martensite phase does not fully revert to the equilibrium cubic austenite phase as the magneto-structural transition is only partially restored with reduced value of 'delta M'. Our results have very significant bearing on application of such alloys as inverse magnetocaloric and barocaloric materials.

cond-mat.mtrl-sci

Incommensurate modulations in stoichiometric Ni2MnGa ferromagnetic shape memory alloy: An overview

This article presents a brief overview of our recent work on the nature of long period modulation in the premartensite and martensite phases of Ni2MnGa ferromagnetic shape memory alloy using high resolution synchrotron x-ray powder diffraction patterns. The commensurate structure model using the Pnnm space group is unable to account for the peak positions of the satellite reflections that appear due to modulations correctly. LeBail and Rietveld refinements using the (3+1)-D super space group $Immm(00γ)s00$ show that the peak positions of all the reflections, including the satellites, can be explained satisfactorily using incommensurate modulations for both the premartensite and martensite phases. The incommensurate modulation vectors are found to be q= 0.33761(5)c* = (1/3+$δ$1)c* and 0.43160(3)c*= (3/7+$δ$2)c*, where $δ$1 and $δ$2 are the degrees of incommensuration for the premartensite and martensite phases, respectively. The periodicity of the closest rational approximant of the premartensite and martensite phases are confirmed to be 3M and 7M, respectively, in agreement with single crystal diffraction results.

cond-mat.mtrl-sci

A high resolution synchrotron x-ray powder diffraction study of the incommensurate modulation in the martensite phase of Ni2MnGa: Evidence for nearly 7M modulation and phason broadening

The modulated structure of the martensite phase of Ni2MnGa is revisited using high resolution synchrotron x-ray powder diffraction (SXRPD) measurements, which reveals higher order satellite reflections up to the 3rd order and phason broadening of the satellite peaks. The structure refinement, using the (3+1) dimensional superspace group approach, shows that the modulated structure of Ni2MnGa can be described by orthorhombic superspace group Immm(00$γ$)s00 with lattice parameters a= 4.21861(2) Å, b= 5.54696(3) Å, and c= 4.18763(2) Å and an incommensurate modulation wave vector q= 0.43160(3)c*= (3/7+$δ$)c*, where $δ$=0.00303(3) is the degree of incommensuration of the modulated structure. Additional satellite peak broadening, which could not be accounted for in terms of the anisotropic strain broadening based on a lattice parameter distribution , has been modeled in terms of phasons using fourth rank covariant strain tensor representation for incommensurate structures. The simulation of single crystal diffraction patterns from the refined structural parameters unambiguously reveals a rational approximant structure with 7M modulation. The inhomogeneous displacement of different atomic sites on account of incommensurate modulation and the presence of phason broadening clearly rule out the adaptive phase model proposed recently by Kaufmann et al.[1] and suggests that the modulation in Ni2MnGa originates from soft-mode phonons.

cond-mat.mtrl-sci

Antiferromagnetic Exchange Interactions in Ni$_{2}$Mn$_{1.4}$In$_{0.6}$ ferromagnetic Heusler alloy

Magnetism in Ni-Mn-Z (Z = Ga,In,Sn,Sb) Heusler alloys has so far been predominantly attributed to Rudermann-Kittel-Kasuya-Yoshida type interactions between Mn atoms. We investigate magnetic interactions in one such alloy, Ni$_{2}$Mn$_{1.4}$In$_{0.6}$ and attempt to explain the origin of antiferromagnetic (AFM) interactions that coexist with ferromagnetic ones. Through the combination of x-ray absorption spectroscopy and x-ray magnetic circular dichroism (XMCD), we find that Ni plays an important role along with Mn in the overall magnetism. A significant hybridization that develops between Mn and Ni orbitals results in a small antiferromagnetic moment at Ni sites. The shift in the XMCD hysteresis loops in the martensitic phase suggests that antiferromagnetism results from superexchange like interactions between Mn atoms mediated by Ni.

cond-mat.mtrl-sci

Modulated structure in the martensite phase of Ni1.8Pt0.2MnGa: a neutron diffraction study

7M orthorhombic modulated structure in the martensite phase of Ni1.8Pt0.2MnGa is reported by powder neutron diffraction study, which indicates that it is likely to exhibit magnetic field induced strain. The change in the unit cell volume is less than 0.5% between the austenite and martensite phases, as expected for a volume conserving martensite transformation. The magnetic structure analysis shows that the magnetic moment in the martensite phase is higher compared to Ni2MnGa, which is in good agreement with magnetization measurement.

cond-mat.mtrl-sci

Quasiperiodic free electron metal layers

Using electron diffraction, we show that free electron metals such as sodium and potassium form a highly regular quasiperiodic monolayer on the fivefold surface of icosahedral Al-Pd-Mn and that the quasiperiodicity propagates up to the second layer in sodium. Our photoelectron spectroscopy results show that the quasicrystalline alkali metal adlayer does not exhibit a pseudogap near the Fermi level, thought to be charactersitic for the electronic structure of quasicrystalline materials. Calculations based on density functional theory provide a model structure for the quasicrystalline alkali metal monolayer and confirm the absence of a pseudogap.

cond-mat.mtrl-sci

Theoretical prediction and experimental study of a ferromagnetic shape memory alloy: Ga_2MnNi

We predict the existence of a new ferromagnetic shape memory alloy Ga_2MnNi using density functional theory. The martensitic start temperature (T_M) is found to be approximately proportional to the stabilization energy of the martensitic phase (deltaE_tot) for different shape memory alloys. Experimental studies performed to verify the theoretical results show that Ga_2MnNi is ferromagnetic at room temperature and the T_M and T_C are 780K and 330K, respectively. Both from theory and experiment, the martensitic transition is found to be volume conserving that is indicative of shape memory behavior.

cond-mat.mtrl-sci

Magnetoresistance behavior of a ferromagnetic shape memory alloy: Ni_1.75Mn_1.25Ga

A negative-positive-negative switching behavior of magnetoresistance (MR) with temperature is observed in a ferromagnetic shape memory alloy Ni_1.75Mn_1.25Ga. In the austenitic phase between 300 and 120 K, MR is negative due to s-d scattering. Curiously, below 120K MR is positive, while at still lower temperatures in the martensitic phase, MR is negative again. The positive MR cannot be explained by Lorentz contribution and is related to a magnetic transition. Evidence for this is obtained from ab initio density functional theory, a decrease in magnetization and resistivity upturn at 120 K. Theory shows that a ferrimagnetic state with anti-ferromagnetic alignment between the local magnetic moments of the Mn atoms is the energetically favoured ground state. In the martensitic phase, there are two competing factors that govern the MR behavior: a dominant negative trend up to the saturation field due to the decrease of electron scattering at twin and domain boundaries; and a weaker positive trend due to the ferrimagnetic nature of the magnetic state. MR exhibits a hysteresis between heating and cooling that is related to the first order nature of the martensitic phase transition.

cond-mat.mtrl-sci

Investigation of unoccupied electronic states of LaCoO$_3$ and PrCoO$_3$ using inverse photoemission spectroscopy and GGA + $U$ calculations

The unoccupied electronic states of LaCoO$_3$ and PrCoO$_3$ are studied using room temperature inverse photoemission spectroscopy and \emph{ab initio} GGA+$\emph{U}$ band structure calculations. A fairly good agreement between experiment and theory is obtained. The intensity of the peak just above the Fermi-level is found to be very much sensitive to the hybridization of Co 3$d$ and O 2$p$ orbitals. Moreover, the band just above the Fermi-level is of Co 3$d$ character with little contribution from O 2$p$ states.

cond-mat.str-el

Martensitic transition, ferrimagnetism and Fermi surface nesting in Mn_2NiGa

The electronic structure of Mn_2NiGa has been studied using density functional theory and photoemission spectroscopy. The lower temperature tetragonal martensitic phase with c/a= 1.25 is more stable compared to the higher temperature austenitic phase. Mn_2NiGa is ferrimagnetic in both phases. The calculated valence band spectrum, the optimized lattice constants and the magnetic moments are in good agreement with experiment. The majority-spin Fermi surface (FS) expands in the martensitic phase, while the minority-spin FS shrinks. FS nesting indicates occurrence of phonon softening and modulation in the martensitic phase.

cond-mat.other

Optimal operating conditions and characteristics of acetone/CaF_2 detector for inverse photoemission spectroscopy

Performance and characteristics of a band-pass photon detector using acetone gas and CaF_2 window (acetone/CaF_2) have been studied and compared with an ethanol/MgF_2 detector. The optimal operating conditions are found to be 4 mbar acetone pressure and 745+/-20 V anode voltage. The count rate obtained by us is about a factor of 3 higher than what has been reported earlier for the acetone detector. Unlike other gas filled detectors, this detector works in the proportional region with very small dead time (4 micro sec). A detector band-pass of 0.48+/-0.01 eV FWHM is obtained.

cond-mat.mtrl-sci

Large negative magnetoresistance in a ferromagnetic shape memory alloy : Ni_{2+x}Mn_{1-x}Ga

5% negative magnetoresistance (MR) at room temperature has been observed in bulk Ni_{2+x}Mn_{1-x}Ga. This indicates the possibility of using Ni_{2+x}Mn_{1-x}Ga as magnetic sensors. We have measured MR in the ferromagnetic state for different compositions (x=0-0.2) in the austenitic, pre-martensitic and martensitic phases. MR is found to increase with x. While MR for x=0 varies almost linearly in the austenitic and pre-martensitic phases, in the martensitic phase it shows a cusp-like shape. This has been explained by the changes in twin and domain structures in the martensitic phase. In the austenitic phase, which does not have twin structure, MR agrees with theory based on s-d scattering model.

cond-mat.mtrl-sci

Influence of Ni doping on the electronic structure of Ni_2MnGa

The modifications in the electronic structure of Ni_{2+x}Mn_{1-x}Ga by Ni doping have been studied using full potential linearized augmented plane wave method and ultra-violet photoemission spectroscopy. Ni 3d related electron states appear due to formation of Ni clusters. We show the possibility of changing the minority-spin DOS with Ni doping, while the majority-spin DOS remains almost unchanged. The total magnetic moment decreases with excess Ni. The total energy calculations corroborate the experimentally reported changes in the Curie temperature and the martensitic transition temperature with x.

cond-mat.mtrl-sci

Spectral functions in doped transition metal oxides

We present experimental photoemission and inverse photoemission spectra of SrTiO$_{3- δ}$ representing electron doped $d^0$ systems. Photoemission spectra in presence of electron doping exhibit prominent features arising from electron correlation effects, while the inverse photoemssion spectra are dominated by spectral features explainable within single-particle approaches. We show that such a spectral evolution in chemically doped correlated systems is not compatible with expectations based on Hubbard or any other similar model. We present a new theoretical approach taking into account the inhomogeneity of the `real' system which gives qualitatively different results compared to standard `homogeneous' models and is in quantitative agreement with experiments.

cond-mat