The present invention relates to the field of signal detection, particularly to a method for enhancing characteristic signals by synthesizing multiple frequency waves.
Sensors play a crucial role in early disease diagnosis, personalized medicine, and rapid detection of toxic substances, significantly impacting environmental monitoring, food safety, and public health. However, effectively detecting samples with extremely low concentrations of biomolecules remains a major challenge. Surface-enhanced infrared absorption (SEIRA) based on plasmonic nanostructures, especially graphene plasmons, has become an effective method to improve biosensor sensitivity. Although graphene plasmon-based SEIRA offers advantages such as ultra-high sensitivity and active tunability, inherent molecular damping reduces the interaction between vibrational modes and plasmons. As a result, at lower concentrations, the spectra of plasmon-enhanced molecular signals become weaker and broader, ultimately getting masked by noise.
To compensate for molecular damping, one method is to add optical gain materials. However, this requires complex setups and may be incompatible with the detection system. Additionally, gain materials often introduce instability and additional noise. Therefore, there is a need for a simple and effective method to compensate for molecular damping to enhance molecular detection.
In light of the aforementioned problems in the prior art, the present invention proposes a method for enhancing characteristic signals by synthesizing multiple frequency waves, which includes:
In one embodiment, the step of obtaining complex frequency responses based on multiple real frequency responses and the complex frequencies to enhance the characteristic signals includes calculating the complex frequency response using the following formula:
In one embodiment, the measurement results of the spectral signals are based on optical detection of molecules, and the complex frequencies are selected to at least partially compensate for losses caused by molecular damping vibrations of the molecular layer.
In one embodiment, the real frequency response approaches zero as the frequency approaches infinity.
In one embodiment, the method further includes:
In one embodiment, the complex frequency response is the extinction I({tilde over (ω)}), and the real frequency response is the intermediate physical quantity P(ω),
In one embodiment, the complex frequency
ω is the current frequency, τ is the attenuation coefficient, and τ is greater than zero and selected to make the dielectric constant of the molecular layer a purely real value.
In one embodiment, the real frequency responses include amplitude information and phase information.
In one embodiment, the method further includes:
In one embodiment, the length of time to is such that the complex frequency response can enter a quasi-steady-state of complex frequencies.
The present invention also provides a computer-readable storage medium comprising a computer program, wherein the computer program is executable by a processor to perform the steps of the aforementioned method.
The present invention also provides an electronic device, comprising:
The method for enhancing characteristic signals by synthesizing multiple frequency waves according to the present invention can be applied in any field to enhance the characteristic signals of spectral signals. The method for enhancing molecular detection by synthesizing multiple frequency waves according to the present invention can reduce molecular damping and significantly enhance molecular signals at extremely low concentrations by coherently combining multiple real frequency waves to synthesize complex frequency waves. Experiments have shown that synthesizing complex frequency waves can amplify molecular signals up to 15 times at low concentrations, thereby improving the sensitivity of various biosensors and enabling quantitative detection of biomolecules. The method for enhancing molecular detection by synthesizing multiple frequency waves according to the present invention is highly scalable, can facilitate the study of light-matter interactions, and has potential applications in fields such as spectroscopy, sensing, metasurfaces, and optoelectronics.
To make the objectives, technical solutions, and advantages of the present invention clearer, the invention will be further described in detail below with reference to the drawings and specific embodiments. It should be noted that the embodiments provided by the present invention are only for illustration and do not limit the scope of the invention.
When light passes through a medium, due to the different frequency components, wave components of different frequencies travel different paths. This phenomenon is called dispersion. The classical dispersion theory is a theory that combines Lorentz's classical electron theory and wave optics theory to study the dispersion characteristics when light waves interact with matter. It regards the inside of the medium as an electron and an “atomic nucleus” undergoing damped vibration due to linear elastic force, similar to an oscillating dipole. This oscillating system absorbs or emits electromagnetic waves according to its natural frequency.
Without loss of generality, the Drude-Lorentz dispersion model is used to model the molecular layer,
where ε(ω) is the dielectric constant of the molecular layer at the incident light frequency ω, which is usually complex. Generally, its imaginary part represents the loss caused by molecular damping vibrations, and its real part represents the refractive index. m is the number of resonance modes of the molecular layer, which is a positive integer. ωm is the resonance frequency of the molecular layer under different resonance modes. γm is the damping rate of the molecular layer under different resonance modes. ωpm is the plasmon frequency of the molecular layer under different resonance modes.
For simplicity, suppose the molecular layer has two vibration modes (i.e., m=2), and suppose the plasmon frequencies ωp1=ωp2=128 cm−1, damping rates γ1=γ2=γM=60 cm−1, and resonance frequencies ω1=1553 cm−1 and ω2=1666 cm−1. Using finite element (FEM) simulation, the extinction spectrum of the molecular layer is obtained, as shown by curve 1 in
then the dielectric constant of the molecular layer becomes purely real, i.e.,
This indicates that a complex-frequency wave (CFW) with appropriate time decay can fully compensate for the damping of molecular vibration modes, i.e., it can compensate for the loss caused by molecular damping vibrations.
Ideally, complex-frequency waves are divergent as time approaches negative infinity. Since it is very difficult to directly generate complex-frequency waves, a new method is used to synthesize truncated complex-frequency waves, represented as:
is the attenuation coefficient representing the decay rate; w is the current frequency; ET(t0) is the intensity of the truncated complex-frequency wave; E0 is the initial intensity of the truncated complex-frequency wave (i.e., at time t0=0); and θ(t0) is a time truncation function to prevent energy divergence, where for t0≥0, θ(t0)=1, and for t0<0, θ(t0)=0.
Based on the Fourier transform, ET(t0) can be expanded as an integral of real frequency components:
The complex frequency {tilde over (ω)}=ω−iτ/2, and the attenuation coefficient τ is chosen to at least partially offset or compensate for the loss caused by molecular damping vibrations of the molecular layer. Preferably, the attenuation coefficient τ is chosen to make the dielectric constant of the molecular layer purely real. The real frequency response F(ωn) is preferably a physical quantity that approaches zero as the frequency approaches infinity, which reduces the error when the number of discrete frequencies is limited.
Based on the above content, the present invention provides a method for enhancing molecular detection by synthesizing complex frequency waves, which can be used in any system for molecular detection based on optical methods, including but not limited to different optical bands, different optical sensors, and different types of spectra, where the measurement light hits the sample molecules and the transmitted or reflected light is measured to calculate corresponding physical quantities, such as extinction and absorption.
Step S201: Obtaining real frequency responses based on the measurement results of molecular optical detection.
The measurement results of molecular optical detection are the optical measurement results after light passes through the molecular layer, which can be, for example, the intensity and/or phase of the reflected and transmitted light after passing through the molecular layer, as well as spectral information. The real frequency response includes amplitude and phase information.
Based on the measurement results of molecular optical detection at multiple incident light frequencies over a period, multiple real frequency responses are obtained.
Step S202: Selecting complex frequencies to at least partially offset or compensate for the loss caused by molecular damping vibrations of the molecular layer.
Step S203: Obtaining complex frequency responses based on multiple real frequency responses and the complex frequencies.
In one embodiment, the complex frequency response can be calculated based on the above formula (2). In another embodiment, the complex frequency response can be calculated based on an integral formula, such as:
Below, the method for enhancing molecular detection by synthesizing complex frequency waves is further explained using extinction I({tilde over (ω)}) as an example.
Extinction is expressed as I(ω)=1−|tM|2, where the transmission coefficient tM=t/ts, and t and ts are the transmission coefficients through the substrate with and without the molecular layer, respectively, which are complex numbers and can be obtained by measurement. Theoretically, the real frequency response tM(ωn) can be obtained based on the measurement results t and ts of molecular optical detection through the above step S201, and then the complex frequency response tM({tilde over (ω)}) can be obtained based on multiple real frequency responses tM(ωn) through the above step S202, and finally, the extinction I({tilde over (ω)}) at the complex frequency can be calculated.
However, since the real frequency response tM(ωn) approaches 1 as the frequency approaches infinity, the final error is large, and the enhancement effect of molecular detection is not obvious. Therefore, an intermediate physical quantity is needed, which can be used to calculate the transmission coefficient tM(ωn), and this intermediate physical quantity approaches zero as the frequency approaches infinity.
For thin-layer systems, tM can be approximated as:
Using equation (3), P(ω) can be derived from the transmission coefficient tM:
It should be noted that, similar to equation (2), equation (4) can also be discretized in practical calculations. P(ω) approaches zero as the frequency approaches infinity. Therefore, the extinction I({tilde over (ω)}) at complex frequencies can be obtained by calculating the response P({tilde over (ω)}) from P(ω):
Accordingly, the enhancement effect of complex-frequency waves can be demonstrated by setting {tilde over (ω)}=ω−iγM/2. Referring again to
Based on the above derivation, the present invention provides a method for enhancing molecular detection by synthesizing complex-frequency waves.
Step S301: Constructing real frequency responses and obtaining real frequency responses P(ω) based on the measurement results t, ts of molecular optical detection. Specifically, constructing real frequency responses P (ω) based on the complex frequency response I({tilde over (ω)}), such that the real frequency response approaches zero as the frequency approaches infinity, where
Based on the measurement results of molecular optical detection at multiple incident light frequencies over a period, multiple real frequency responses are obtained.
Step S302: Selecting complex frequencies to at least partially offset or compensate for the loss caused by molecular damping vibrations of the molecular layer.
Step S303: Obtaining intermediate complex frequency responses P({tilde over (ω)}) based on multiple real frequency responses P(ω).
Step S304: Obtaining complex frequency responses I({tilde over (ω)}) based on the intermediate complex frequency responses P({tilde over (ω)}).
Below, the extinction spectrum of the molecular layer is simulated using a graphene sensor as an example. In the first example, the positions of the two characteristic peaks of the molecular layer used for simulation are 1540 cm−1 and 1635 cm−1; in the second example, the positions of the two characteristic peaks of the molecular layer used for simulation are 1570 cm−1 and 1620 cm−1.
Therefore, in practical applications, the real frequency response F(ωn) should be chosen as a physical quantity that approaches zero as the frequency approaches infinity to further enhance the results of molecular detection.
Although extinction is used as an example in the above embodiments, the present invention is not limited to this. The complex frequency response of the present invention can be any physical quantity directly or indirectly calculated based on the measurement results of molecular optical detection.
In the above embodiments, molecular optical detection is used as an example for detailed description, but those skilled in the art should understand that the method for enhancing characteristic signals by synthesizing complex-frequency waves can be applied to any field of spectral signals, including but not limited to spectroscopy, electron energy loss spectroscopy, angle-resolved photoelectron spectroscopy, mechanical characteristic spectroscopy, and acoustic spectroscopy.
Step S701: Obtaining real frequency responses based on the measurement results of spectral signals. Based on the measurement results of spectral signals at multiple frequencies over a period, multiple real frequency responses are obtained.
Step S702: Selecting complex frequencies to at least partially offset or compensate for the spectral line broadening caused by the loss inherent in the measurement results of spectral signals.
Step S703: Obtaining complex frequency responses based on multiple real frequency responses and the complex frequencies to enhance the characteristic signals.
Specifically, the complex frequency response can be calculated based on the above formula (2)
where F({tilde over (ω)}) is the complex frequency response. ωn is the frequency of the measurement results of spectral signals, and F(ωn) is the real frequency response. The complex frequency {tilde over (ω)}=ω−iτ/2, and the attenuation coefficient τ is chosen to at least partially offset or compensate for the spectral line broadening caused by the loss inherent in the measurement results of spectral signals.
In embodiments where the horizontal coordinate is not frequency, the horizontal coordinate of the measurement results of spectral signals can be used as their virtual frequency ωn, and the virtual phase information of spectral signals can be obtained based on the amplitude information (i.e., the vertical coordinate) of spectral signals through the Kramers-Kronig relation. Those skilled in the art should understand that although virtual frequency and virtual phase do not have actual physical meaning, they can be used for mathematical calculations.
For ease of understanding, in the present invention, frequency includes actual frequency and virtual frequency used for mathematical calculations, and phase includes actual phase and virtual phase used for mathematical calculations.
The method for enhancing characteristic signals by synthesizing complex-frequency waves according to the present invention can be applied in any field to enhance the characteristic signals of spectral signals, which can be, for example, dip signals, peak signals, etc.
The method for enhancing molecular detection by synthesizing complex-frequency waves according to the present invention. By coherently combining multiple real frequency waves into complex-frequency waves, molecular damping can be reduced, significantly enhancing molecular signals at extremely low concentrations. Experiments have shown that synthesizing CFW can amplify molecular signals up to 15 times at low concentrations, thereby improving the sensitivity of various biosensors and enabling quantitative detection of biomolecules. The method for enhancing molecular detection by synthesizing complex-frequency waves according to the present invention is highly scalable, can promote the study of light-matter interactions, and has potential applications in the fields of spectroscopy, sensing, metasurfaces, optical waveguides, and logic devices.
Although the present invention has been described through preferred embodiments, it is not limited to the described embodiments. Various changes and modifications made without departing from the scope of the present invention are included.
Number | Date | Country | Kind |
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202310809421.8 | Jul 2023 | CN | national |