Low Structure Research Articles

Structure Determination of Zinc and Cadmium Dication Complexes with Intact and Deprotonated Histidyl Glycine and Glycyl Histidine Dipeptides.

Metalated intact and deprotonated histidyl glycine and glycyl histidine dipeptides were investigated in the gas phase by using infrared multiple photon dissociation (IRMPD) spectroscopy with light from a free-electron laser (FEL). The dipeptides M2+(GlyHis), M2+(HisGly), [M(GlyHis-H)]+, and [M(HisGly-H)]+, where M = Zn and Cd, were probed to elucidate how the His position along the peptide chain and ligand charge state might influence the structures observed in the gas phase. Simulated annealing calculations were performed to determine energetically low-lying conformers and isomers of these structures. Quantum chemical calculations were used to optimize the structures at the B3LYP level of theory using the 6-311+G(d,p) and def2-TZVP basis sets for zinc and cadmium complexes, respectively. IRMPD and calculated linear absorption spectra were compared to evaluate which structures are present. Relative energies of the various species were evaluated using single-point energy calculations for low-lying structures at the B3LYP, B3LYP-GD3BJ, ωB97XD, and MP2(full) levels using the 6-311+G(2d,2p) and def2-TZVPP basis sets. For all species, structures for both metals mirror each other, and those that reproduce the experimental spectrum were determined to be iminol structures for the intact ligands or iminol-like structures for the deprotonated ligands. Additionally, when the spectra of the deprotonated dipeptides are compared to the intact dipeptides, the change in the spectra is correlated to the group that is deprotonated.

The aromatic amino acid phenylalanine: a versatile tool for binding transition metal ions.

The human body contains many different types of transition metal ions, such as Zn2+, Cu2+, which are involved in many physiological processes. An excess or deficiency of these ions can cause diseases, such as Alzheimer's disease, which is closely related to the levels of these ions in the body. In-depth understanding of various physiological and pathological mechanisms related to metal ions requires understanding the interaction between metal ions and nearby amino acids at the atomic level. This article selected four transition metal ions: Zn2+, Cu2+, Fe2+, and Mn2+ and the aromatic amino acid Phe, known for its strong coordination capability, as study subjects, comprehensively examining their binding situations. The results show that there are multiple binding modes between them and Phe, and most of the binding modes involve benzene ring coordination. The coordination strength order of the four metal ions with benzene ring, carbonyl O, hydroxyl O and amino N is different. For the lowest energy structure formed by each ion with Phe, all four ions are bound to N, carbonyl O, and benzene ring. Zn2+ is combined with two C's of the benzene ring, Cu2+ with four C's of the benzene ring, and Fe2+ and Mn2+ with the benzene ring as a whole. Part of the reason for this phenomenon may be derived from the tendency of transition metal ions to reach 18e stable structures when bound to ligands. There is a strong binding force between the four ions and Phe, and the binding trend is Cu2+(-294.9kcal/mol) > Zn2+(-261.3kcal/mol) > Fe2+(-247.5kcal/mol) > Mn2+(-220.2kcal/mol). Mayer bond order analysis and molecular orbital localization analysis found that there are very strong chemical interactions between transition metal ions and surrounding atoms, especially with N and carbonyl O. Several initial structures with different coordination modes to Phe were created according to chemical intuition for each divalent cation. Then semiempirical MD simulations at GFN2 level were run on these structures. The numerous generated structures were classified according to some criteria, then representative geometries were preliminarily optimized by TPSSh/6-31G*/LanL2DZ. To get more accurate electronic energies, high-precision quantum chemistry calculations at the level of TPSSh/def2TZVPP//TPSSh/def2QZVPP were carried out on the selected low-lying structures. All the optimized structures were confirmed to be minima without imaginary frequency by performing frequency analyses. Further electronic structure analyses such as IRI, Mayer bond order, IBSI etc. were performed to get more insights into the binding between the transition metal ions and Phe.

Reevaluation of structures in Se70 from combined conversion-electron and γ -ray spectroscopy

In the selenium isotopes various shape phenomena are present, in particular, the emergence of a dominant oblate deformation in the most neutron-deficient isotopes has been observed. The scenario of shape coexisting oblate and prolate bands has been proposed across the isotopic chain, with the crossing point of such bands being located near Se70, where no coexistence has yet been identified. To determine the presence or absence of any low-lying 0+ state in Se70, confirm the level structure, and interpret the nuclear deformation with theoretical models. A combined internal-conversion-electron and γ-ray spectroscopy study was undertaken with the SPICE and TIGRESS spectrometers at the TRIUMF-ISAC-II facility. Nuclear models were provided by the generalized triaxial rotor model (GTRM) and the collective generalised Bohr Hamiltonian (GBH). Despite a comprehensive search, no evidence was found for the existence of a 0+ state below 2 MeV in Se70. Significant discrepancies to the previously established positive-parity-level scheme were found. GBH calculations using UNEDF1 mass parameters were found to reproduce the revised low-lying level structure well. Se70 does not have a well-defined axial shape. The 22+ state at 1601 keV resembles a quasi-γ excitation rather than a member of a shape coexisting band; the presence of such a band is all but ruled out.Published by the American Physical Society2024

Geometric and electronic properties of anionic precious metal gold doped boron clusters AuB n − (n = 10–20)

Recently, the Au–B covalent bonds in gold doped boron clusters has attracted great attention. However, there are fewer theoretical reports on exploration their ground state structures and stabilities, especially for the medium sizes. Here, we study the structural evolution and electronic properties of the anionic Au doped boron clusters with medium sizes of n from 10 to 20 using the unbiased cluster structural searches combined with density functional theory (DFT) calculations. The results reveal that the quasi-planar AuB18 − (1A, C 1) cluster shows excellent stability and a large vertical separation energy (VDE) of 4.25 eV. The good consistency between the computationally simulated photoelectron spectra and the experimental spectra strongly supports the correctness of our low-lying structures. Further bonding analyses show that the well-stabilized aromatic AuB18 − cluster is due to the active σ interactions between Au atom (6s orbitals) and B units (2p orbitals), as well as the large number of σ–bonds in the B18 − moiety with π-aromaticity. These findings enriched the family of Au-B alloy clusters and metal-doped boron-based aromatic clusters, which provide valuable information for the experimental characterization and preparation of boron-rich alloy nanoclusters in the future.

Probing the Structural and Electronic Properties of the Anionic and Neutral Tellurium-Doped Boron Clusters TeBnq (n = 3-16, q = 0, -1).

In this study, we employ density functional theory along with the artificial bee colony algorithm for cluster global optimization to explore the low-lying structures of TeBnq (n = 3-16, q = 0, -1). The primary focus is on reporting the structural properties of these clusters. The results reveal a consistent doping pattern of the tellurium atom onto the in-plane edges of planar or quasi-planar boron clusters in the most energetically stable isomers. Additionally, we simulate the photoelectron spectra of the cluster anions. Through relative stability analysis, we identify three clusters with magic numbers -TeB7-, TeB10, and TeB12. The aromaticity of these clusters is elucidated using adaptive natural density partitioning (AdNDP) and magnetic properties analysis. Notably, TeB7- exhibits a perfect σ-π doubly aromatic structure, while TeB12 demonstrates strong island aromaticity. These findings significantly contribute to our understanding of the structural and electronic properties of these clusters.

High-precision spectral inversions: Determining what is important for the accurate definition of incident radiation boundary conditions

Context. Spectral inversions are used to analyse spectroscopic observations with the aim of deriving the physical properties of the observed plasma, such as the kinetic temperature, density, pressure, degree of ionisation, or macroscopic velocities. One of the key factors ensuring the high precision of the derived plasma properties is having accurately defined input parameters of the models on which spectral inversions rely. The illumination, which chromospheric and coronal structures receive from the solar surface (and corona), is one of the most crucial input parameters of these models. Aims. We do not perform spectral inversions in this work. Our aim is to study two important factors that contribute to the accurate definition of the incident radiation boundary conditions: the altitude above the solar surface and the dynamics of the illuminated plasma. This investigation takes into account a diverse range of solar structures from the high-rising eruptive prominences to low-lying spicules. Methods. To study the influence of the altitude and dynamics of the observed plasma on the incident radiation boundary conditions, we used geometrical principles valid for any spectral line. However, to demonstrate the strong impact of dynamics, we considered the specific case of narrow spectral lines of Mg II H&K, which are highly sensitive to the presence of velocities. Results. We argue that the altitude of the illuminated plasma strongly influences the way we need to define the incident radiation boundary conditions to achieve the most accurate results. For low-lying structures, generally below 50 000 km, the incident radiation may need to be specified directly from the composition of the portion of the solar disc that illuminates them. For high-altitude structures, generally above 300 000 km, the fraction of the solar disc illuminating the analysed plasma is large enough to be realistically approximated by the composition of the entire disc. We also show that for the narrow spectral lines, such as the Mg II H&K lines, the impact of dynamics on the incident radiation intensity and profile shapes starts from radial velocities of 30 km s−1. Such velocities are even exhibited by the fine structures of quiescent prominences and are easily exceeded in spicules or eruptive prominences. Conclusions. The two aspects of the incident radiation definition studied here are relevant for spectral inversions based on any kind of modelling approach. However, their impact on the precision of the results of spectral inversions is likely less significant than the impact of the choice of the complexity of the model geometry, for example.

Structural characterizations of histidine-containing tripeptides complexed with zinc and cadmium dications using IRMPD spectroscopy and theoretical calculations

Metalated gas-phase complexes, M2+(HisAlaAla), M2+(AlaHisAla), and M2+(AlaAlaHis), where M = Zn and Cd, were examined using infrared multiple photon dissociation (IRMPD) spectroscopy with light from a free-electron laser (FEL). These complexes were chosen because they provide model systems for metal binding to proteins. Complementary simulated annealing calculations were performed to determine energetically low-lying conformers and isomers of these structures. Quantum chemical calculations were used to optimize the structures at the B3LYP level of theory using 6-311+G(d,p) and def2-TZVP basis sets for zinc and cadmium complexes, respectively. IRMPD and calculated linear absorption spectra were compared to evaluate which structures are present. Relative energies of the various species were evaluated using single-point energy calculations for low-lying structures at the B3LYP, B3P86, and MP2(full) levels using 6-311+G(2d,2p) and def2-TZVPP basis sets. For species with histidine at a terminal position (AAH or HAA), the conformations that best reproduce the IRMPD spectra are charge-solvated (CS) conformers, where the metal dication binds to the amine and carbonyl groups of the peptide backbone and to the nitrogen of the histidine side chain, along with contributions from an iminol structure for AAH. The species with the histidine in the center position (AHA) adopt an iminol structure, where the metal dication binds to the backbone iminol nitrogens, the α-amine, π-imine, and the carbonyl of the C-terminus.

Novel hard and unusual superconducting monoclinic phase of FeB2C2: An ab initio evolutionary study

This study focuses on conducting an ab initio evolutionary investigation to search for stable polymorphs of iron diborocarbides with the formula FeB2C2. We also examined other forms of C contents, including FeB3C and FeBC3. Our findings reveal that the lowest energetic structure of FeB2C2 is a semimetallic monoclinic phase with a space group (s.g.) of C2/m and a metastable metallic phase of FeB2C2 is an orthorhombic structure with s.g. of Pmmm. In addition, structural and relative properties of FeB3C and FeBC3 are performed and discussed to compare with FeB2C2. All predicted structures are dynamically and elastically stable, verified without negative phonon frequency and Born criteria, respectively. We also analyzed the energetic stability through calculated cohesive and formation energies, which showed that C2/m-FeB2C2 is stable at low pressure. Interestingly, the C2/m and Pmmm phases of FeB2C2 are hard materials with Vickers hardness (Hv) of 22.40 and 27.52 GPa, respectively. Additionally, we examined the electron–phonon coupling of both FeB2C2 phases. Unexpectedly, we found that the semimetallic C2/m-FeB2C2 phase is a superconductor with a significant superconducting temperature (Tc) exceeding 6 K. These findings provide some novel results for the Fe–B–C system and pave the way for investigating other metal borocarbides and related ternary compounds.

Structural evolution and hydrogen storage properties of ScHn− (n = 10–20) clusters

An unbiased Crystal structure AnaLYsis by Particle Swarm Optimization (CALYPSO) method combined with density functional theory (DFT) study was adopted to identify the ground state ScHn− (n = 10–20) isomers. We have performed a series of investigation of electronic properties, structural evolution, hydrogen storage properties of ScHn− (n = 10–20) clusters. Using time-dependent (TD-) DFT, the photoelectron spectra (PES) of the low-lying structures of ScHn− clusters have been simulated. The adsorption energies of ScHn− (n = 10–20) clusters are found in 2.52 eV-2.65 eV, and all hydrogen atoms are adsorbed on the Sc atom. Studied on the molecular orbitals and chemical bonds of the ScH12− cluster, it is found that the ScH12− cluster are mainly the interaction between the 3d atom orbital of Sc and the 1s atom orbital of H. The present study aims at novel nanomaterials for hydrogen storage.

Stereoisomers of oxime ethers of 1,4-naphthoquinone: Synthesis, characterization, X-ray crystal structures, and DFT studies

In the present work, we use the C-3 substituted 2-hydroxy-1,4-naphthoquinones viz. 2-hydroxynaphthalene-1,4-dione (1), 2-hydroxy-3-methylnaphthalene-1,4-dione (2), and 2-chloro-3-hydroxynaphthalene-1,4-dione (3) as starting materials and obtained naphthoquinoneoxime ethers viz. 3-hydroxy-4-(methoxyimino)naphthalen-1(4H)-one (4), 3-hydroxy-4-(methoxyimino)-2-methylnaphthalen-1(4H)-one (5) and 2-chloro-3-hydroxy-4-(methoxyimino)naphthalen-1(4H)-one (6) via a facile and efficient synthesis involving condensation with methoxyamine hydrochloride. X-ray structure showed that 4 belongs to the orthorhombic (P212121) space group, whereas 5 and 6 (P21/c) crystalize in the monoclinic crystal system. The isomer ratios derived from NMR experiments elucidating stereoisomerism in compounds comprised of carbon-nitrogen double bonds have been analyzed; the naphthoquinone oxime ethers 4, 5, and 6 were also characterized employing the ωB97x-D/6–311++G (d, p) level of density functional theory. Theoretical studies reveal different conformational isomers with the ‘amphi’ and ‘syn’ isomers as low-lying structures along their energy hierarchy in accordance with the X-ray crystallography data. The spectral characterization of vibrational frequencies and 1H /13C NMR chemical shifts in unison with experiments and theory has been presented.

Cross-catenation between position-isomeric metallacages

The study of cross-catenated metallacages, which are complex self-assembly systems arising from multiple supramolecular interactions and hierarchical assembly processes, is currently lacking but could provide facile insights into achieving more precise control over low-symmetry/high-complexity hierarchical assembly systems. Here, we report a cross-catenane formed between two position-isomeric Pt(II) metallacages in the solid state. These two metallacages formed [2]catenanes in solution, whereas a 1:1 mixture selectively formed a cross-catenane in crystals. Varied temperature nuclear magnetic resonance experiments and time-of-flight mass spectra are employed to characterize the cross-catenation in solutions, and the dynamic library of [2]catenanes are shown. Additionally, we searched for the global-minimum structures of three [2]catenanes and re-optimized the low-lying structures using density functional theory calculations. Our results suggest that the binding energy of cross-catenanes is significantly larger than that of self-catenanes within the dynamic library, and the selectivity in crystallization of cross-catenanes is thermodynamic. This study presents a cross-catenated assembly from different metallacages, which may provide a facile insight for the development of low-symmetry/high-complexity self-assemble systems.

Two-Dimensional Electronic Spectroscopy Reveals Dynamics within the Bright Fine Structure of CdSe Quantum Dots.

Semiconductor quantum dots are characterized by a discrete excitonic structure featuring coarse as well as fine structure. The lowest fine structure states have splittings into bright-dark states which are now well confirmed by single dot spectroscopy. In contrast, the splitting of the lowest coarse exciton into bright-bright fine structure states has not been observed nor the dynamics between these states. Here, we use the unique combination of time and energy resolution of two-dimensional electronic spectroscopy to directly observe the fine structure splittings into a bright-bright doublet. These splittings are strongly size dependent, with population relaxation on the <100 fs time scale.

GENESIS: Gamma Energy Neutron Energy Spectrometer for Inelastic Scattering

Improved neutron inelastic scattering cross section data are needed to inform integral benchmark studies and advance applications in a wide variety of areas including nuclear energy, stockpile stewardship, nonproliferation, and space exploration. Neutron inelastic scattering also serves as a non-selective probe of low-lying nuclear structure. To help meet these needs, the Gamma Energy Neutron Energy Spectrometer for Inelastic Scattering (GENESIS) was constructed at the 88-Inch Cyclotron at Lawrence Berkeley National Laboratory. This array couples high-resolution γ-ray detectors and fast neutron detectors to achieve single and coincident n/γ detection over a broad energy range. The current configuration of the array includes 26 organic liquid scintillators and four high-purity germanium detectors (two single-crystal and two four-crystal CLOVER detectors with two-fold segmentation). The array was constructed with minimal supporting material and designed to cover a wide range of secondary particle angles and energies with limited inter-element scattering. Data acquisition is accomplished using Mesytec MDPP-16 multi-channel high-resolution digital pulse processing modules. The array characteristics, including γ-ray and neutron energy resolution, timing resolution, and detection efficiency were measured and used to validate a Geant4 model of the array. The primary sources of neutron background and the uncertainties in the determination of incident and secondary neutron energy were assessed. GENESIS provides a new capability to address nuclear data needs and facilitates the advancement of a wide range of nuclear applications.

Rheological behavior of cellulose nanofibril suspensions with varied levels of fines and solid content

The rheological behavior of mechanically disk refined cellulose nanofibril (CNF) aqueous suspensions with 50, 60, 70, 80, 90, 100 % fines contents at 1 and 3 wt% solid concentrations was studied by conducting various dynamic and steady-state rheological experiments, including oscillatory shear, flow sweep, startup, flow loop, and three-step oscillation experiments. All the samples exhibited a gel-like behavior in oscillatory shear tests and samples, with 50 % fines showed the highest levels of dynamic moduli for both solid contents. Suspensions with higher concentrations of CNFs showed higher values for viscosity, complex viscosity, and dynamic moduli. A critical shear rate of 10 s−1 independent of the solid contents of the suspensions was found for varying fines levels, where viscosity measurements above this critical shear rate converged and viscosity measurements below it diverged. All samples exhibited yield in shear flow and yield stresses exhibited a decreasing trend followed by a plateau as fines levels increased. The level of yield stress for 3 wt% suspensions was higher than that of 1 wt% suspensions. The lowest structure recovery was observed for samples containing 50 % fines content. Moreover, a rheopectic-thixotropic transition was observed for samples with high fines content (90 and 100 %) at low solid content (1 wt%).

Structural and vibrational spectroscopic signature of a bio-relevant molecule: (E)-3-(2-(4-methoxyphenyl)hydrazineylidene)chromane-2, 4-dione

The investigation of possible low-lying conformational structures of a bio-relevant molecule named (E)-3-(2-(4-methoxyphenyl)hydrazineylidene)chromane-2, 4-dione in gas phase has been performed with respect to possible dihedral angle. While searching for the possible numbers of conformers of the target molecule, DFT/B3LYP/6-31++G(d,p) level of theory was adopted. We have also recorded FTIR spectra of the target molecule in the range of 4000–400 cm−1, which have been correlated with the theoretically simulated IR spectra of the target molecule. The normal coordinate analysis has been employed to calculate potential energy distributions in order to explore the vibrational dynamics of the target molecule. The natural bond orbital (NBO) computations are also performed. Moreover, HOMO and LUMO analysis has been performed to understand the transition profile.

Cross-shell states in 15C: A test for p-sd interactions

The low-lying structure of 15C has been investigated via the neutron-removal 16C(d,t) reaction. Along with the known bound neutron sd-shell states, unbound p-shell hole states have been observed. The excitation energies and the deduced spectroscopic factors of the cross-shell states are an important measure of the [(p)−1(sd)2] neutron configurations in 15C. Our results show a very good agreement with shell-model calculations using the SFO-tls interaction for 15C. However, this same interaction predicted energies that were too low for the corresponding hole states in the N=9 isotone 17O and adjustment of the p-sd and sd-sd monopole terms was required to match the 17O energies. In addition, the excitation energies and spectroscopic factors have been compared to the first calculations of 15C with the ab initio self-consistent Green's function method employing the NNLOsat interaction. The results show the sensitivity to the size of the N=8 shell gap and highlight the need to go beyond the current truncation scheme.

Disentangling relations between dynamic urban structure and its efficiency in 287 cities across China

Conventionally urban structures are mainly inferred from the spatial arranges of related urban elements such as land use and population density. China's unprecedented urbanization process has significantly changed urban spatial structure and it is not clear how urban structure impacts the sustainability and livability of cities across a large geographic space. Furthermore, urban structure always shows dynamical variations during the day and over the night, which are a challenge to be captured by the conventional research methods and data. In this paper, we evaluated and compared the characteristics of the urban structure of the 287 cities in China by examining the dynamic changes of urban human activities distribution inferred from location requests collected by Tencent's platform. We developed two new indexes, the Dispersion Variation Index (DVI) and Spatial Dispersion Variation Index (SDVI), using the Lorenz curve, Gini coefficient, and adjusted Ripley's K function to describe the overall agglomeration intensity and the temporal variability of human activities. We also applied the urban scaling law to create two further indexes, the Scale-Adjusted Metropolitan Indicator DVI (SAMI_DVI) and the Scale-Adjusted Metropolitan Indicator SDVI (SAMI_SDVI), which enable us to evaluate the efficiency of urban structures. Our results show that the daily fluctuations of the urban structure are related to urban population, and also impacted by urban planning, topography, and other factors. The 1st-tier cities have the highest DVI (median: 0.020) and SDVI (0.052) values, which suggest the most volatile urban structure during the day. The 2nd-tier cities have the lowest urban structure efficiency, as suggested by higher SAMI_DVI (0.17) and SAMI_SDVI (0.28) values. Also, 69.2% and 76.9% of the 2nd-tier cities have DVI and SDVI values over the predicted values based on their population sizes. We also demonstrate that cities with high unstable structural characteristics tend to exhibit lower commuting efficiency and higher carbon emission intensity. Our framework outperforms previous metrics, is highly scalable, and can be implemented at little cost, allowing studies to be conducted even in small and medium-sized cities with little traditional data.

Flat bands, non-trivial band topology and rotation symmetry breaking in layered kagome-lattice RbTi3Bi5

A representative class of kagome materials, AV3Sb5 (A = K, Rb, Cs), hosts several unconventional phases such as superconductivity, {{mathbb{Z}}}_{2} non-trivial topological states, and electronic nematic states. These can often coexist with intertwined charge-density wave states. Recently, the discovery of the isostructural titanium-based single-crystals, ATi3Bi5 (A = K, Rb, Cs), which exhibit similar multiple exotic states but without the concomitant charge-density wave, has opened an opportunity to disentangle these complex states in kagome lattices. Here, we combine high-resolution angle-resolved photoemission spectroscopy and first-principles calculations to investigate the low-lying electronic structure of RbTi3Bi5. We demonstrate the coexistence of flat bands and several non-trivial states, including type-II Dirac nodal lines and {{mathbb{Z}}}_{2} non-trivial topological surface states. Our findings also provide evidence for rotational symmetry breaking in RbTi3Bi5, suggesting a directionality to the electronic structure and the possible emergence of pure electronic nematicity in this family of kagome compounds.

Emergence of triaxiality in 74Se from electric monopole transition strengths

The structure of 74Se at low energy was investigated via spectroscopy of internal conversion electrons at the INFN Legnaro National Laboratories (LNL). A set of internal K-conversion coefficients and monopole transition strengths was measured. A large ρ2(E0;22+→21+)⋅103=210(130) value was deduced. This result, in addition to a low upper limit for the 03+→02+ electron transition, casts in doubt a simple interpretation of the 74Se low-lying structure, in particular the recently proposed spherical, vibrational character. New microscopic beyond-mean-field calculations generally agree with the experimental results and are capable of producing a large ρ2(E0;22+→21+) value, even if still a factor ≈7 smaller than the experiment. Triaxiality and a complex shape-coexistence and mixing scenario seem responsible for this unexpected experimental result.

KONTRIBUSI KOMPONEN DESTINASI WISATA DALAM MENDUKUNG PEMBANGUNAN DESA DI KABUPATEN PANGANDARAN

Pengembangan sektor pariwisata dalam konteks pembangunan wilayah menunjukan perubahan yang terjadi di wilayah sekitar destinasi wisata. Dampak pengembangan sektor pariwisata pada skala terkecil dapat dirasakan oleh masyarakat sekitar destinasi wisata atau dalam struktur pemerintahan paling rendah adalah pemerintah desa. Perkembangan sektor pariwisata tidak terlepas dari komponen destinasi wisata, yakni daya tarik, aksesibilitas, amenitas, serta pengelolaan dan pelayanan destinasi wisata. Penelitian dilakukan pada lima belas destinasi wisata yang berada di Kabupaten Pangandaran, Provinsi Jawa Barat. Tujuan penelitian ini yakni untuk mengidentifikasi komponen destinasi wisata dan kontribusinya terhadap pembangunan desa. Metode penelitian yang digunakan dalam penelitian ini yakni metode campuran. Metode kuantitatif dilakukan dengan menggunakan analisis statistik deskriptif yaknin analisis multidimesional scaling (MDS) untuk mengidentifikasi komponen destinasi wisata dan analisis kualitatif dilakukan menggunakan analisis konten terhadap data hasil wawancara dengan narasumber kunci yakni kepala desa dan stakeholder yang memiliki wewenang dalam bidang pariwisata untuk mengetahui kontribusi destinasi wisata terhadap pembangunan desa. Data penelitian yang digunakan yakni data primer dan data sekunder, dengan data primer yang didapatkan dari hasil wawancara dan observasi serta data sekunder berupa data dan dokumen dari lembaga yang berkaitan dengan sektor pariwisata. Hasil penelitian ini menunjukan pengelompokan destinasi wisata berdasarkan komponen atraksi, aksesibilitas, amenitas, serta pengelolaan dan pelayanannya. Terdapat destinasi wisata yang memiliki komponen pariwisata yang memadai begitupula sebaliknya. Dapat disimpulkan bahwa komponen destinasi wisata memberikan kontribusi positif terhadap pembangunan desa, salah satunya melalui pelibatan masyarakat dalam pengelolaan destinasi wisata. Meskipun demikian, dalam penelitian ini ditemukan beberapa destinasi wisata yang tidak memberikan kontribusi terhadap pembangunan wilayah desa.