Studies on the growth, optical, electrical and spectral properties of potassium pentaborate (KB5) single crystals

The bulk single crystals of nonlinear optical material potassium pentaborate (KB5) have been grown by slow evaporation solution growth technique using water as solvent. The grown crystal was confirmed by single crystal X-ray diffraction studies. The structural perfection of the grown crystals has been analyzed by high resolution X-ray diffraction (HRXRD) studies by recording rocking curve. The photoluminescence (PL), UV-vis spectral studies were performed and the optical bandgap of the material was calculated. FTIR and FT-Raman measurements enumerate the functional groups present in the compound. The factor group analysis on KB5 reveals that there are 117 vibrational optical modes. The dielectric behavior of KB5 was investigated with different frequencies and temperatures.     

Growth and characterization of 2-hydroxy-4-methoxybenzophenone single crystal using modified vertical Bridgman technique

The 2-hydroxy-4-methoxybenzophenone single crystal has been grown by the modified vertical Bridgman technique using the double wall ampoule. The grown crystal was confirmed by single and powder X-ray diffraction (XRD) and Fourier transform infrared (FTIR) spectroscopy analyses. High resolution X-ray diffraction (HRXRD) analysis indicates the crystalline perfection of the grown crystal. The cutoff wavelength of the grown crystal was analyzed by optical studies. The dielectric measurements were carried out and the results indicate an increase in dielectric and conductivity parameters with the increase of temperature at all frequencies. The thermal property of the grown crystal was studied by thermo gravimetric (TG) and differential thermal analyses (DTA).     

Synthesis, growth, spectral, thermal, mechanical and optical properties of 4-chloro-4′dimethylamino-benzylidene aniline crystal: A third order nonlinear optical material

An organic nonlinear optical material, 4-chloro-4′dimethylamino-benzylidene aniline (CDMABA), was synthesized by the condensation of the p-chloroaniline and p-dimethylaminobenzaldehyde. Solubility of CDMABA was determined in acetone at different temperatures. Single crystals were grown by the solvent evaporation method from acetone solution at room temperature. Grown crystal was subjected to FTIR, FT-Raman and ¹H NMR spectral analyses to confirm the synthesized compound. The range and percentage of optical transmission was ascertained by recording UV–vis–NIR spectrum. Thermal properties were investigated by Thermo Gravimetric, Differential Thermal and Differential Scanning Calorimetric analyses. High Resolution X-ray Diffractometry (HRXRD) was employed to evaluate the perfection of the grown crystal. The third order nonlinear optical parameters (nonlinear refractive index and nonlinear absorption coefficient) were derived by the Z-scan technique.     

Growth and characterization of sodium pentaborate [Na(H4B5O10)] single crystals

The bulk single crystals of sodium pentaborate [Na(H4B5O10)] were grown by slow evaporation solution growth technique using deionized water as solvent. The grown crystal was confirmed by single crystal X-ray diffraction studies. The structural perfection of the grown crystals has been analyzed by high resolution X-ray diffraction (HRXRD) studies by recording rocking curve. The photoluminescence (PL), UV-vis spectral studies were performed and the optical bandgap of the material was calculated. The presence of the functional groups was identified by FT-IR measurement. The factor group analysis was done on Na(H4B5O10) to reveal the vibrational optical modes. The thermal and mechanical properties of the grown crystal were studied by TG-DTA and Vickers microhardness tester, respectively. The dielectric behavior of Na(H4B5O10) was investigated with different frequencies and temperatures.     

Growth and characterization of 2-amino-4-picolinium toluene sulfonate single crystal

2-Amino-4-picolinium toluene sulfonate (2A4PTS), a new organic material, was synthesized and grown as single crystals in room temperature by slow evaporation solution growth technique using water as solvent. The crystal structure of 2A4PTS has been determined using single crystal X-ray diffraction studies. 2A4PTS belongs to monoclinic crystal system. The molecular arrangements in the crystal were studied. The structural perfection of the grown crystals has been analysed by high-resolution X-ray diffraction (HRXRD) rocking curve measurements. Fourier transform infrared (FTIR) spectral studies have been performed to identify the functional groups. The optical transmittance window and the lower cutoff wavelength of the 2A4PTS have been identified by UV–Vis–NIR studies. The nonlinear optical properties have been investigated by Z-scan method. The nonlinear refractive index and linear absorption coefficient of the 2A4PTS are found to be in the order of 10⁻⁸ cm²/W and 10⁻⁴ cm/W, respectively. The laser induced surface damage threshold for the grown crystal was measured using Nd:YAG laser. Thermal analysis carried out on the compound reveals that 2A4PTS is stable up to 133 °C. The microhardness test was carried out and the load dependent hardness was measured.     

Growth and characterization of thiosemicarbazide hydrochloride: a semiorganic NLO material

Thiosemicarbazide hydrochloride (TSCHCL) was synthesized by mixing thiosemicarbazide and hydrochloride in 1:1 molar ratio in double distilled water. Single crystals of TSCHCL were grown by slow evaporation at room temperature and were characterized by single crystal X-ray diffraction study to determine the molecular structure and by FT-IR, ¹H and ¹³C NMR spectral analyses to confirm the synthesized compound. Thermogravimetric and differential thermal analyses reveal the thermal stability of the crystal. The transmission spectrum of TSCHCL showed that the crystal is transparent in the wavelength range 380–1100 nm. High resolution X-ray diffractometry (HRXRD) was employed to evaluate the perfection of the grown crystal. Mechanical properties of the grown crystal were studied using Vickers microhardness test. Second harmonic generation efficiency of the powdered TSCHCL was tested using Nd:YAG laser and is ∼1.5 times that of potassium dihydrogen orthophosphate.     

Growth, optical, mechanical and thermal studies of diglycine cadmium chloride single crystal

Transparent single crystals of diglycine cadmium chloride were grown by slow evaporation solution technique. To confirm the crystal structure, the grown crystals were subjected to single crystal as well as powder X-ray diffraction measurements and the structure was found to be monoclinic. The elemental analysis was carried out by energy dispersive X-ray spectroscopy. The crystalline perfection of the grown crystal was assessed by high-resolution X-ray diffractometry and found that the crystal quality is fairly good. The optical study reveals that the grown crystal is highly transparent in the region 250?C900?nm. Thermal studies reveal that the grown crystal is stable up to 245?°C. The michrohardness analysis revealed that the grown crystal belongs to soft material category. The high dielectric constant (>30) and low loss (<0.01) value also confirms that the grown crystal is a good candidate for device fabrications.     

Crystallization,spectral, and thermal characterization of <Emphasis Type="SmallCaps">l</Emphasis>-histidine methyl ester dihydrochloride (LHMED)

A novel nonlinear optical semi-organic single crystal of l-histidine methyl ester dihydrochloride was grown by slow evaporation solution growth method at an ambient temperature. The grown crystal was characterized by single crystal X-ray diffraction. Functional groups and the modes of vibrations were identified by FT–IR spectroscopy. The chemical composition of the crystal was confirmed by Energy dispersive X-ray analysis. The optical behavior of the crystal was examined by UV spectral analysis, which shows the absence of absorption between the wavelengths ranging from 230 to 1000 nm. The optical band gap of the grown crystal was estimated and is found to be 5.35 eV. The thermal behavior of the crystal was investigated by thermogravimetric and differential thermal analyses. The nonlinear optical property of the grown crystal was confirmed by the powder technique of Kurtz and Perry.     

Synthesis, growth, optical, mechanical, dielectric and thermal properties of 4-chloro-4'-chlorobenzylidene aniline single crystal

The organic material 4-chloro-4′-chlorobenzylidene aniline (CCBA) was synthesized and confirmed by NMR and FTIR spectral analyses. CCBA crystal was grown from chloroform by slow evaporation at room temperature and the single crystal cell parameters were determined by single crystal X-ray diffraction method. The perfection of the grown crystal was analyzed by high resolution X-ray diffraction rocking curve analysis. Fluorescence spectrum indicated violet emission at 428 nm. The range of optical absorbance was ascertained by recording UV–vis–NIR spectrum. Load dependant microhardness measurements on this crystal revealed the mechanical behavior of the material. Stiffness constant, Meyer index and yield strength of CCBA crystal were calculated. Dielectric studies were carried out to estimate the dielectric parameters of the grown crystal in the frequency range from 100 Hz to 100 kHz. The thermal behavior of CCBA was investigated using differential scanning calorimetry (DSC) and no phase transition was identified in the temperature region 30–100 °C. Further, the CCBA crystal was subjected to open aperture Z-scan studies in order to investigate the third order nonlinear optical (NLO) properties of CCBA crystal.     

Crystal growth, structural, optical, spectral and thermal studies of tris(L-phenylalanine)L-phenylalaninium nitrate: a new organic nonlinear optical material

Tris(L-phenylalanine)L-phenylalaninium nitrate, C(9)H(12)NO(2)(+)·NO(3)(-)·3C(9)H(11)NO(2) (TPLPN), a new organic nonlinear optical material was grown from aqueous solution by slow evaporation solution growth at room temperature. The grown crystals were subjected to powder X-ray diffraction and single crystal X-ray diffraction studies to confirm the crystalline nature and crystal structure. The modes of vibration of different molecular groups present in TPLPN have been identified by FTIR spectral analysis. The presence of hydrogen and carbon in the grown crystal were confirmed by using proton and carbon nuclear magnetic resonance (NMR) spectral analyses. The optical transmission spectral study establishes good transmitting ability of the crystal in the entire visible region. The thermogravimetric (TG) and differential thermal analyses (DTA) were carried out to understand the thermal stability of the sample. The nonlinear optical property of the compound observed using Kurtz powder second harmonic generation test assets the suitability of the grown material for the frequency conversion of laser radiation of Nd:YAG.     

Growth, structural, spectral, mechanical, thermal and dielectric characterization of phosphoric acid admixtured L-alanine (PLA) single crystals

Phosphoric acid admixtured L-alanine (PLA) single crystals were grown successfully by solution method with slow evaporation technique at room temperature. Crystals of size 18 mm×12 mm×8 mm have been obtained in 28 days. The grown crystals were colorless and transparent. The solubility of the grown samples has been found out at various temperatures. The lattice parameters of the grown crystals were determined by X-ray diffraction technique. The reflection planes of the sample were confirmed by the powder X-ray diffraction study and diffraction peaks were indexed. Fourier transform infrared (FTIR) studies were used to confirm the presence of various functional groups in the crystals. UV-visible transmittance spectrum was recorded to study the optical transparency of grown crystal. The nonlinear optical (NLO) property of the grown crystal was confirmed by Kurtz-Perry powder technique and a study of its second harmonic generation efficiency in comparison with potassium dihydrogen phosphate (KDP) has been made. The mechanical strength of the crystal was estimated by Vickers hardness test. The grown crystals were subjected to thermo gravimetric and differential thermal analysis (TG/DTA). The dielectric behavior of the sample was also studied.     

Spectral, optical, and thermal studies of pure and Zn(II)-doped l-histidine hydrochloride monohydrate (LHHC) crystals

The influence of doping the transition metal Zn(II) on the growth, spectral, optical, and thermal properties of l-histidine hydrochloride monohydrate (LHHC) crystals grown by slow solvent evaporation method has been investigated. Structural characterizations of the grown crystals were carried out by single crystal X-ray diffraction analysis and it shows slight structural changes as a result of doping. The FT-IR spectral study reveals the presence of various functional groups and confirms the slight distortion of the structure of the crystals due to doping. The energy dispersive X-ray analysis reveals the incorporation of Zn(II) in the crystalline matrix of LHHC crystal. The UV?CVis spectral study was carried out to analyze the optical transmittance of the grown crystals and found that the transmittance is very high in the visible and UV regions for both pure and doped crystals. The second harmonic generation (SHG) for the grown crystals was confirmed by Nd:YAG laser. The scanning electron microscopy reveals the presence of defect centers and crystal voids. The thermal stability and purity of the grown crystals were analyzed by thermogravimetry, differential thermal analysis, and differential scanning calorimetry techniques.     

Growth Defects in Cubic KTa1-xNbxO3 Crystal

Potassium tantalate niobate （KTa1-xNbxO3, KTN） crystals with different dimensions and quality situations were grown by Czochralski method. Crystal growth process and morphology properties of KTN are presented in this paper. It was found that some defects, such as bubble, inclusion, crack, dislocation etc., can all appear if the crystal is grown in an improper condition. The character and formation mechanism of such defects in macro growth are discussed. We consider that the CO2, which was not released absolutely during the sintering process and dissolved in the melt, led to bubbles. The composition of the inclusion caused by high pulling and rotation rates is KTN polycrystalline. The crack and dislocation in KTN crystal mainly come from improper temperature field. Etching and high-resolution X-ray diffraction （HRXRD） experiment results indicate that the central area is the defects concentrated.     

Characterization of 4-chloro-3-nitrobenzophenone crystal grown by Bridgman technique

The large size 12 mm diameter 4-chloro-3-nitrobenzophenone (4C3N) single crystal has been grown by using vertical Bridgman technique. The grown crystal was confirmed by Powder X-ray diffraction analysis. The crystalline perfection of the grown crystal was examined by high-resolution X-ray diffraction study. The cutoff wavelength of the grown crystal was analyzed by optical studies. The thermal property of the grown crystal was studied by thermogravimetric and differential thermal analyses. The fluorescence spectra of grown 4C3N single crystals exhibit emission peak at 575 nm. The microhardness measurements were used to analyze the mechanical property of the grown crystal. The laser-induced surface damage threshold for the grown crystal was measured using Nd:YAG laser.     

Synthesis, growth and characterization of 4-bromo-4'chloro benzylidene aniline--a third order non linear optical material

The organic nonlinear optical material of 4-bromo-4'chloro benzylidene aniline (BCBA) was synthesized and single crystal of BCBA was grown from acetone solution by solvent evaporation method at room temperature. Its three dimensional structure was elucidated from single crystal X-ray diffraction analysis at 173 K. Synthesized compound of BCBA was subjected to FTIR and (1)H and (13)C NMR spectral analyses. The range and percentage of optical transmission of BCBA was determined by UV-vis-NIR spectrum and its fluorescence spectrum was recorded using spectrofluorometer. The mechanical strength of the crystal was estimated using Vickers microhardness test on the (001) plane. Dielectric constant of the grown crystal was measured for various frequencies along (001) plane. The third order nonlinear optical properties of BCBA were investigated by Z-scan technique with He-Ne laser radiation of wavelength at 632.8 nm and the corresponding nonlinear refractive index, absorption coefficient and optical susceptibility were calculated.     

FTIR, FT Raman and thermal studies of bisthiourea manganese chloride--an organo metallic crystal

The organometallic crystal bisthiourea manganese chloride (BTMC) was grown by slow evaporation technique using water as solvent. The lattice parameters of the grown crystal have been determined by X-ray diffraction studies. Vibrational spectra were recorded to determine the symmetries of molecular vibrations. The observed Raman and infrared bands were also assigned and discussed. The optical transmission spectral study revealed the transmitting ability of the crystal in the entire visible region. The TGA/DTA analysis explains the thermal stability of the investigated crystal.     

Growth,optical, thermal,dielectric and mechanical studies of sodium hydrogen succinate single crystal

Sodium hydrogen succinate, an alkali metallo-organic third-order nonlinear optical crystal, had been grown successfully using aqueous solution by slow evaporation technique at room temperature. Transparent single crystals were selected and subjected to single-crystal X-ray diffraction analysis to identify lattice parameters, space group and morphology. The grown crystal was further subjected to powder X-ray diffraction to analyze the crystalline quality, UV–Vis–NIR spectral analysis to reveal optical transparency, FTIR spectroscopy for confirmation of the functional group analysis and TG–DTG/DSC analysis to determine the thermal stability. The dielectric constant and dielectric loss were studied as a function of frequency at different temperatures, and the results were discussed. The mechanical properties were calculated by Vickers microhardness test, and the third-order nonlinear optical parameters such as nonlinear refractive index, nonlinear absorption coefficient and real and imaginary parts of the third-order nonlinear optical susceptibility were determined by Z-scan technique.     

Crystal growth, thermal and optical studies on a semiorganic nonlinear optical material for blue-green laser generation

The semiorganic nonlinear optical material l-histidine bromide (l-HB) has been synthesized in aqueous solution and characterized by FT-IR, FT-Raman and FT-NMR spectroscopic techniques. The single crystals with dimensions 9mm x 4mm x 3mm were grown by slow evaporation techniques. The grown crystals were subjected to single crystal X-ray diffraction to determine the unit cell dimensions. The thermal stability of the grown crystal was analyzed by thermogravimetric (TG), differential thermal (DT) and differential scanning calorimetric (DSC) analyses. The UV-vis transmittance spectrum shows that it has a good optical transmittance in the entire visible region with the lower cutoff wavelength at 220 nm. The SHG conversion efficiency and laser damage threshold were measured using a Nd:YAG laser (1064 nm). The optical birefringence was measured in the visible region as a function of temperature in the range 30-150 degrees C by interference technique.     

Crystal growth, spectral, optical, and thermal characterization of glycyl-l-alanine hydrochloride (GLAH) single crystal

A new semi-organic nonlinear optical material glycyl-l-alanine hydrochloride (GLAH) was grown successfully by slow evaporation solution growth method. The solubility of GLAH was estimated for a wide range of temperatures. Large size single crystal of size 15?×?9?×?6?mm³ was grown at room temperature. The grown crystal was subjected to single crystal X-ray diffraction study which confirms that the grown crystal is monoclinic in nature with the space group P2₁. The molecular weight of the title compound was estimated by mass spectrometry. Functional groups and the modes of vibrations were identified by FT-IR spectral analysis. The UV?Cvisible spectral study reveals that the percentage of optical transmission of the sample is very high in the entire visible and UV regions. The second harmonic generation of the crystal was confirmed by the Kurtz and Perry technique. The hardness of the sample was tested by microhardness test which shows that the grown crystal belongs to the soft category of materials. The thermal stability of the compound was studied by TG?CDTA analyses which indicate that the crystal is thermally stable up to 248.6?°C.     

Synthesis,growth, structure and characterization of nickel(II)-doped hexaaquacobalt(II) dipotassium tetrahydrogen tetra-o-phthalate tetrahydrate crystals

Single crystals of K₂[Co_(1−x)Ni_x(H₂O)₆] (C₈H₅O₄)₄·4H₂O (x = 0.25) (PCNHP), a semiorganic black colored transparent crystal of size ∼20 × 13 × 4 mm³, are grown from an aqueous solution of potassium hydrogen phthalate enriched with cobalt chloride and nickel chloride by slow evaporation solution growth technique at room temperature. Structural analysis by single crystal X-ray diffraction reveals that the crystal belongs to monoclinic system with space group P2₁/c and the cell parameters are a = 10.41(3) Å, b = 6.84(2) Å, c = 29.46(9) Å, Z = 4. Incorporation of both Co(II) and Ni(II) into the potassium hydrogen phthalate (KHP) crystal lattice is well confirmed by EDS and chemical tests. Powder XRD profiles indicate the crystallinity and FT-IR studies reveal the vibrational patterns. The UV–vis optical absorption spectrum of PCNHP shows the lower optical cut-off at ∼300 nm and the crystal was transparent in the entire visible region. The crystalline perfection of the grown crystal analysed by high-resolution X-ray diffraction (HRXRD) analysis reveals that the diffraction curve (DC) contains multi-peaks with low angular spread indicating the possibility of low angle structural grain boundaries. Scanning electron microscope (SEM) studies indicate the structure defect centers. The dielectric, thermal and mechanical behaviors of the specimen were also investigated.