Related papers: Pressure driven neutral-ionic transition in ClMePD…
Results of in situ high pressure x-ray powder diffraction on the mixed valence compound Cs2Au(I)Au(III)I6 (CsAuI3) are reported, for pressures up to 21 GPa in a diamond anvil cell under hydrostatic conditions. We find a reversible…
We investigated the mixed-stack charge-transfer crystal, N,N'-dimethylphenazine-TCNQ (M$_2$P-TCNQ), which is polar at room temperature and just at the neutral-to-ionic interface (ionicity $\rho \approx 0.5$). We detect the typical…
Uranium ditelluride (UTe$_2$) has attracted recent interest due to its unique superconducting properties, which include the potential for a topological odd-parity superconducting state. Recently, ac-calorimetry measurements under pressure…
Understanding the properties of molecular solids at high pressure is a key element in the development of new solid-state theories. However, the most commonly used generalized-gradient approximation (GGA) of the density functional theory…
We report the effects of hydrostatic pressure on the temperature-induced phase transitions in Fe1.08Te in the pressure range 0-3 GPa using synchrotron powder x-ray diffraction (XRD). The results reveal a plethora of phase transitions. At…
Electronic structure calculations on the low dimensional spin-1/2 compound TiOCl were performed at several pressures in the orthorhombic phase, finding that the structure is quasi-one-dimensional. The Ti3+ (d1) ions have one t2g orbital…
We find that the Debye-H\"uckel nonideality of dilute aqueous electrolytes is sufficient to drive volume phase transitions and criticality, even in the absence of a self-attracting or elastic network. Our result follows from a Landau…
We report systematic investigation of high pressure crystal structures and structural phase transition upto 46 GPa in CaFeAsF and 40 GPa in SrFeAsF at 40 K using powder synchrotron x-ray diffraction experiments and Rietveld analysis of the…
First-order, rhombohedral to orthorhombic, stress-induced phase transitions have been evidenced by bulk charge-stress measurements and X-ray diffraction derived lattice strain measurements in [001]c-poled PZN-4.5PT. The transitions are…
At ambient pressure CaFe2As2 has been found to undergo a first order phase transition from a high temperature, tetragonal phase to a low temperature orthorhombic / antiferromagnetic phase upon cooling through T ~ 170 K. With the application…
High pressure electrical resistance and x-ray diffraction measurements have been performed on ruthenium-doped Ba(Fe0.9Ru0.1)2As2, up to pressures of 32 GPa and down to temperatures of 10 K, using designer diamond anvils under…
The structural analogue of iron-based superconductors the BaMn$_2$P$_2$ and BaMn$_2$As$_2$ compounds under hydrostatic pressure upto 140 GPa were studied within the framework of DFT+U. The transition from an antiferromagnetic (AFM)…
Topological transition metal dichalcogenides (TMDCs) have attracted much attention due to its potential applications in spintronics and quantum computations. In this work, we systematically investigate the structural and electronic…
The heavy fermion antiferromagnet CeNiGe2 was investigated under pressure by resistivity and ac calorimetry up to 4 GPa and down to 40 mK. The two magnetic transitions found in both resistivity and specific heat at 0.1 GPa at T_N1=3.95 and…
Several calorimetric measurements have shown that 1-ethyl-3-methylimidazolium dicyanamide, [C2C1im][N(CN)2], is a glass-forming liquid, even though it is a low-viscous liquid at room temperature. Here we found slow crystallization during…
We have studied the influence of external pressure up to 1 GPa on the magnetic transitions of the orthorhombic Haldane-spin chain compound Tb2BaNiO5 an exotic multiferroic material. This parent compound is known to undergo N\'eel ordering…
When subjected to pressure, the prototypical heavy-fermion antiferromagnet CeRhIn5 becomes superconducting, forming a broad dome of superconductivity centered around 2.35 GPa (=P2) with maximal Tc of 2.3 K. Above the superconducting dome,…
Resistance measurements on single crystals of CaK(Fe$_{1-x}$Mn$_x$)$_4$As$_4$ ($x$ = 0.024) were performed under hydrostatic pressure up to 5.15 GPa. The pressure dependence of the magnetic and superconducting transition temperatures and…
We calculated the Madelung energies of both the ground state and excited states in tetrathiafulvalene - p-chloranil (TTF-CA) by taking into account intramolecular charge distribution. The distribution is found to be significant in the…
Fast-ion conductors such as BaSnF4 are of significant interest for next-generation solid-state battery technologies due to their high ionic conductivity and chemical stability. However, the behaviour of these materials under extreme…