arXiv subjects

C. M. Adhikari

Publications and source records attributed to C. M. Adhikari.

16 recordsLinked to original sources

arXiv2026

AIMBio-Mat: An AI-Native FAIR Platform for Closed-Loop Materials Discovery and Biomedical Translation

Materials discovery and biomedical translation increasingly require models that can reason across composition, processing, structure, biological response, manufacturability, safety, and governance constraints. Existing materials and biomedical data ecosystems are powerful but remain poorly coupled for AI-guided discovery. Here we present AIMBio, a conceptual framework for an AI-native, FAIR, and governance-aware decision layer that links materials provenance, biomedical context, knowledge graphs, uncertainty-aware machine learning, and human-in-the-loop active learning. The framework formulates biomedical-materials discovery as constrained multi-objective optimization under uncertainty and introduces practical requirements for metadata, model documentation, risk-tiered governance, evaluation metrics, and phased implementation. To make the roadmap testable, we add a minimum viable prototype specification and a worked pilot for AI-guided nanomaterials for drug delivery. AIMBio is positioned as exploratory and preclinical discovery infrastructure, not as clinical decision-support software; any clinical or regulated-device use would require separate validation, change control, and regulatory review. The central contribution is a publishable platform blueprint for converting fragmented materials and biomedical records into auditable, experimentally actionable, and translationally responsible discovery workflows.

physics.app-ph↗

arXiv2026

Building a Regional Data-Centric Materials Science Ecosystem for Processing-Rich Materials Innovation in the Great Plains

Data-centric materials science is changing how materials are discovered, optimized, manufactured, and qualified, yet many deployment-limiting materials problems still depend on experimental, processing-rich, device-level, and field-relevant data that are difficult to capture in conventional materials databases. This perspective argues that the Great Plains and adjacent interior research corridor can make a distinctive national contribution by organizing distributed experimental assets into a trusted regional materials-data ecosystem. The proposed model emphasizes FAIR metadata, provenance, persistent sample identifiers, uncertainty-aware modeling, semi-closed-loop workflows, stackable workforce training, and tiered governance for academic, public, controlled-access, and industry-protected data. We identify five coupled barriers -- fragmented data, weak algorithm--laboratory translation, uneven access to cyberinfrastructure and technical staff, workforce gaps at the materials--data interface, and insufficient incentives for sharing and reuse -- and propose a staged roadmap for addressing them. A high-purity germanium pilot illustrates how regional strengths can be converted into reusable datasets, benchmark models, trained personnel, and decision-improving workflows. The broader message is that regional leadership in data-centric materials science will depend less on geographic concentration than on trustworthy data practices, interoperable infrastructure, cross-trained people, and application-driven materials challenges.

cond-mat.mtrl-sci↗

arXiv2022

Quantum Electrodynamics of Dicke States: Resonant One-Photon Exchange and Entangled Decay Rate

We calculate the one-photon exchange contribution to the interatomic interaction potential between electrically neutral, identical atoms, one of which is assumed to be in an excited state, by matching the scattering matrix (S matrix) element with the effective Hamiltonian. This approach allows us to use covariant perturbation theory, where the two possible time orderings of emission and absorption are summarized in a single Feynman amplitude. Our results encompass the full retardation correction to the one-photon exchange van-der-Waals potential. We employ the temporal gauge for the virtual photon propagator. Based on the Feynman prescription, we obtain the imaginary part of the interaction energy, which leads to an interaction-induced correction to the decay rate. Our results lead to precise formulas for the distance-dependent enhancement and suppression of the decay rates of entangled superradiant and subradiant Dicke state, as a function of the interatomic distance. We apply the result to an example calculation involving two hydrogen atoms, one of which is in the ground state, the other in an excited P state.

physics.atom-ph↗

arXiv2022

Temperature-dependent dielectric function of intrinsic silicon: Analytic models and atom-surface potentials

The optical properties of monocrystalline, intrinsic silicon are of interest for technological applications as well as fundamental studies of atom-surface interactions. For an enhanced understanding, it is of great interest to explore analytic models which are able to fit the experimentally determined dielectric function $ε(T_Δ, ω)$, over a wide range of frequencies and a wide range of the temperature parameter $T_Δ= (T-T_0)/T_0$, where $T_0 = 293\,{\rm K}$ represents room temperature. Here, we find that a convenient functional form for the fitting of the dielectric function of silicon involves a Lorentz-Dirac curve with a complex, frequency-dependent amplitude parameter, which describes radiation reaction. We apply this functional form to the expression $[ε(T_Δ, ω) -1]/[ ε(T_Δ, ω)+2]$, inspired by the Clausius-Mossotti relation. With a very limited set of fitting parameters, we are able to represent, to excellent accuracy, experimental data in the (angular) frequency range $0 < ω< 0.16 \, {\rm a.u.}$ and $0< T_Δ< 2.83$, corresponding to the temperature range $ 293\,{\rm K} < T < 1123\, {\rm K}$. Using our approach, we evaluate the short-range $C_3$ and the long-range $C_4$ coefficients for the interaction of helium atoms with the silicon surface. In order to validate our results, we compare to a separate temperature-dependent direct fit of $ε(T_Δ, ω)$ to the Lorentz-Dirac model.

cond-mat.mtrl-sci↗

arXiv2020

Controlled Exciton-Plasmon Coupling in a Mixture of Ultrathin Periodically Aligned Single-Wall Carbon Nanotube Arrays

We study theoretically the in-plane electromagnetic response and the exciton-plasmon interactions for an experimentally feasible carbon nanotube (CN) film systems composed of parallel aligned periodic semiconducting CN arrays embedded in an ultrathin finite-thickness dielectric. For homogeneous single-CN films, the intertube coupling and thermal broadening bring the exciton and interband plasmon resonances closer together. They can even overlap due to the inhomogeneous broadening for films composed of array mixtures with a slight CN diameter distribution. In such systems the real part of the response function is negative for a broad range of energies (negative refraction band), and the CN film behaves as a hyperbolic metamaterial. We also show that for a properly fabricated two-component CN film, by varying the relative weights of the two constituent CN array components one can tune the optical absorption profile to make the film transmit or absorb light in the neighborhood of an exciton absorption resonance on-demand.

cond-mat.mes-hall↗

arXiv2019

Pressure Shifts in High-Precision Hydrogen Spectroscopy: I. Long-Range Atom-Atom and Atom-Molecule Interactions

We study the theoretical foundations for the pressure shifts in high-precision atomic beam spectrosopy of hydrogen, with a particular emphasis on transitions involving higher excited P states. In particular, the long-range interaction of an excited hydrogen atom in a 4P state with a ground-state and metastable hydrogen atom is studied, with a full resolution of the hyperfine structure. It is found that the full inclusion of the 4P_1/2 and 4P_3/2 manifolds becomes necessary in order to obtain reliable theoretical predictions, because the 1S ground state hyperfine frequency is commensurate with the 4P fine-structure splitting. An even more complex problem is encountered in the case of the 4P-2S interaction, where the inclusion of quasi-degenerate 4S-2P_1/2 state becomes necessary in view of the dipole couplings induced by the van der Waals Hamiltonian. Matrices of dimension up to 40 have to be treated despite all efforts to reduce the problem to irreducible submanifolds within the quasi-degenerate basis. We focus on the phenomenologically important second-order van der Waals shifts, proportional to 1/R^6 where R is the interatomic distance, and obtain results with full resolution of the hyperfine structure. The magnitude of van der Waals coefficients for hydrogen atom-atom collisions involving excited P states is drastically enhanced due to energetic quasi-degeneracy; we find no such enhancement for atom-molecule collisions involving atomic nP states, even if the complex molecular spectrum involving ro-vibrational levels requires a deeper analysis.

physics.atom-ph↗

arXiv2019

Pressure Shifts in High-Precision Hydrogen Spectroscopy: II. Impact Approximation and Monte-Carlo Simulations

We investigate collisional shifts of spectral lines involving excited hydrogenic states, where van der Waals coefficients have recently been shown to have large numerical values when expressed in atomic units. Particular emphasis is laid on the recent hydrogen 2S-4P experiment (and an ongoing 2S-6P experiment) in Garching, but numerical input data are provided for other transitions (e.g., involving S states), as well. We show that the frequency shifts can be described, to sufficient accuracy, in the impact approximation. The pressure related effects were separated into two parts, (i) related to collisions of atoms inside of the beam, and (ii) related to collisions of the atoms in the atomic beam with the residual background gas. The latter contains both atomic as well as molecular hydrogen. The dominant effect of intra-beam collisions is evaluated by a Monte-Carlo simulation, taking the geometry of the experimental apparatus into account. While, in the Garching experiment, the collisional shift is on the order of 10 Hz, and thus negligible, it can decisively depend on the experimental conditions. We present input data which can be used in order to describe the effect for other transitions of current and planned experimental interest.

physics.atom-ph↗

arXiv2018

Close Examination of the Ground-State Casimir-Polder Interaction: Time-Ordered Versus Covariant Formalism and Radiative Corrections

The purpose of this paper is twofold. First, we compare, in detail, the derivation of the Casimir-Polder interaction using time-ordered perturbation theory, to the matching of the scattering amplitude using quantum electrodynamics. In the first case, a total of twelve time-ordered diagrams need to be considered, while in the second case, one encounters only two Feynman diagrams, namely, the ladder and crossed-ladder contributions. For ground-state interactions, we match the contribution of six of the time-ordered diagrams against the corresponding Feynman diagrams, showing the consistency of the two approaches. Second, we also examine the leading radiative correction to the long-range interaction, which is of relative order O(alpha^3). In doing so, we uncover logarithmic terms, in both the interatomic distance as well as the fine-structure constant, in higher-order corrections to the Casimir-Polder interaction.

physics.atom-ph↗

arXiv2018

Relativistic and Radiative Corrections to the Dynamic Stark Shift: Gauge Invariance and Transition Currents in the Velocity Gauge

We investigate the gauge invariance of the dynamic (ac) Stark shift under "hybrid" gauge transformations from the "length" (E.r) to the "velocity" (A.p) gauge. By a "hybrid" gauge transformation, we understand a transformation in which the scalar and vector potentials are modified, but the wave function remains unaltered. The gauge invariance of the leading term is well known, while we here show that gauge invariance under perturbations holds only if one takes into account an additional correction to the transition current, which persists only in the velocity gauge. We find a general expression for this current, and apply the formalism to radiative and relativistic corrections to the dynamic Stark effect, which is described by the sum of two polarizability matrix elements.

physics.atom-ph↗

arXiv2017

Long-Range Interactions for Hydrogen: 6P-1S and 6P-2S

The collisional shift of a transition constitutes an important systematic effect in high-precision spectroscopy. Accurate values for van der Waalsinteraction coefficients are required in order to evaluate the distance-dependent frequency shift. We here consider the interaction of excited hydrogen 6P atoms with metastable atoms (in the 2S state), in order to explore the influence of quasi-degenerate 2P, and 6S states on the dipole-dipole interaction. The motivation for the calculation is given by planned high-precision measurements of the transition. Due to the presence of quasi-degenerate levels, one can use the non-retarded approximation for the interaction terms over wide distance ranges.

physics.atom-ph↗

arXiv2017

Long-range interactions of hydrogen atoms in excited states. III. nS-1S interactions for n >= 3

The long-range interaction of excited neutral atoms has a number of interesting and surprising properties, such as the prevalence of long-range, oscillatory tails, and the emergence of numerically large can der Waals C_6 coefficients. Furthermore, the energetically quasi-degenerate nP states require special attention and lead to mathematical subtleties. Here, we analyze the interaction of excited hydrogen atoms in nS states (3 <= n <= 12) with ground-state hydrogen atoms, and find that the C_6 coefficients roughly grow with the fourth power of the principal quantum number, and can reach values in excess of 240,000 (in atomic units) for states with n = 12. The nonretarded van der Waals result is relevant to the distance range R << a_0/alpha, where a_0 is the Bohr radius and alpha is the fine-structure constant. The Casimir-Polder range encompasses the interatomic distance range a_0/alpha << R << hbar c/L, where L is the Lamb shift energy. In this range, the contribution of quasi-degenerate excited nP states remains nonretarded and competes with the 1/R^2 and 1/R^4 tails of the pole terms which are generated by lower-lying mP states with 2 <= m <= n-1, due to virtual resonant emission. The dominant pole terms are also analyzed in the Lamb shift range R >> hbar c/L. The familiar 1/R^7 asymptotics from the usual Casimir-Polder theory is found to be completely irrelevant for the analysis of excited-state interactions. The calculations are carried out to high precision using computer algebra in order to handle a large number of terms in intermediate steps of the calculation, for highly excited states.

physics.atom-ph↗

arXiv2017

Virtual Resonant Emission and Oscillatory Long-Range Tails in van der Waals Interactions of Excited States: QED Treatment and Applications

We report on a quantum electrodynamic (QED) investigation of the interaction between a ground state atom with another atom in an excited state. General expressions, applicable to any atom, are indicated for the long-range tails which are due to virtual resonant emission and absorption into and from vacuum modes whose frequency equals the transition frequency to available lower-lying atomic states. For identical atoms, one of which is in an excited state, we also discuss the mixing term which depends on the symmetry of the two-atom wave function (these evolve into either the gerade or the ungerade state for close approach), and we include all nonresonant states in our rigorous QED treatment. In order to illustrate the findings, we analyze the fine-structure resolved van der Waals interaction for nD-1S hydrogen interactions with n=8,10,12 and find surprisingly large numerical coefficients.

quant-ph↗

arXiv2017

Long-range interactions of hydrogen atoms in excited states. I. 2S-1S interactions and Dirac-delta perturbations

The theory of the long-range interaction of metastable excited atomic states with ground-state atoms is analyzed. We show that the long-range interaction is essentially modified when quasi-degenerate states are available for virtual transitions. A discrepancy in the literature regarding the van der Waals coefficient C_6(2S;1S) describing the interaction of metastable atomic hydrogen (2S state) with a ground-state hydrogen atom is resolved. In the the van der Waals range a_0 << R << a_0/alpha, where a_0= hbar/(alpha m c) is the Bohr radius and alpha is the fine structure constant, one finds the symmetry-dependent result E_{2S;1S}(R) ~ (-176.75 +/- 27.98) E_h (a_0/R)^6 (E_h denotes the Hartree energy). In the Casimir-Polder range a_0/alpha << R << hbar c/L, where L = E(2S_{1/2})-E(2P_{1/2}) is the Lamb shift energy, one finds E_{2S;1S}(R) ~ (-121.50 +/- 46.61) E_h (a_0/R)^6. In the the Lamb shift range R >> hbar c/L, we find an oscillatory tail with a negligible interaction energy below 10^(-36) Hz. Dirac-delta perturbations to the interaction are also evaluated and results are given for all asymptotic distance ranges; these effects describe the hyperfine modification of the interaction, or, expressed differently, the shift of the hydrogen 2S hyperfine frequency due to interactions with neighboring 1S atoms. The 2S hyperfine frequency has recently been measured very accurately in atomic beam experiments.

physics.atom-ph↗

arXiv2017

Long-range interactions of hydrogen atoms in excited states. II. Hyperfine-resolved 2S-2S system

The interaction of two excited hydrogen atoms in metastable states constitutes a theoretically interesting problem because of the quasi-degenerate 2P_{1/2} levels which are removed from the 2S states only by the Lamb shift. The total Hamiltonian of the system is composed of the van der Waals Hamiltonian, the Lamb shift and the hyperfine effects. The van der Waals shift becomes commensurate with the 2S-2P_{3/2} fine-structure splitting only for close approach (R < 100 a_0, where a_0 is the Bohr radius) and one may thus restrict the discussion to the levels with n=2 and J=1/2 to good approximation. Because each S or P state splits into an F=1 triplet and an F=0 hyperfine singlet (eight states for each atom), the Hamiltonian matrix {\em a priori} is of dimension 64. A careful analysis of symmetries the problem allows one to reduce the dimensionality of the most involved irreducible submatrix to 12. We determine the Hamiltonian matrices and the leading-order van der Waals shifts for states which are degenerate under the action of the unperturbed Hamiltonian (Lamb shift plus hyperfine structure). The leading first- and second-order van der Waals shifts lead to interaction energies proportional to 1/R^3 and 1/R^6 and are evaluated within the hyperfine manifolds. When both atoms are metastable 2S states, we find an interaction energy of order E_h chi (a_0/R)^6, where E_h and L are the Hartree and Lamb shift energies, respectively, and chi = E_h/L ~ 6.22 \times 10^6 is their ratio.

physics.atom-ph↗

arXiv2016

Adjacency Graphs and Long-Range Interactions of Atoms in Quasi-Degenerate States: Applied Graph Theory

We analyze, in general terms, the evolution of energy levels in quantum mechanics, as a function of a coupling parameter, and demonstrate the possibility of level crossings in systems described by irreducible matrices. In long-range interactions, the coupling parameter is the interatomic distance. We demonstrate the utility of adjacency matrices and adjacency graphs in the analysis of "hidden" symmetries of a problem; these allow us to break reducible matrices into irreducible subcomponents. A possible breakdown of the no-crossing theorem for higher-dimensional irreducible matrices is indicated, and an application to the 2S-2S interaction in hydrogen is briefly described. The analysis of interatomic interactions in this system is important for further progress on optical measurements of the 2S hyperfine splitting.

quant-ph↗

arXiv2016

Magic wavelength for the hydrogen 1S-2S transition: Contribution of the continuum and the reduced-mass correction

Recently, we studied the magic wavelength for the atomic hydrogen 1S-2S transition [A.K., Phys. Rev. A 92, 042507 (2015)]. An explicit summation over virtual atomic states of the discrete part of the hydrogen spectrum was performed to evaluate the atomic polarizability. In this paper, we supplement the contribution of the continuum part of the spectrum and add the reduced-mass correction. The magic wavelength, at which the lowest-order ac Stark shifts of the 1S and 2S states are equal, is found to be equal to 514.6 nm. The ac Stark shift at the magic wavelength is -221.6 Hz / (kW/cm^2), and the slope of the ac Stark shift at the magic wavelength under a change of the driving laser frequency is -0.2157 Hz/ (GHz kW/cm^2).

physics.atom-ph↗