Abstract

We present a scanning tunneling microscopy (STM) and ab-initio study of the anisotropic superconductivity of 2H-NbSe2 in the charge-density-wave (CDW) phase. Differential-conductance spectra show a clear double-peak structure, which is well reproduced by density functional theory simulations enabling full k- and real-space resolution of the superconducting gap. The hollow-centered (HC) and chalcogen-centered (CC) CDW patterns observed in the experiment are mapped onto separate van der Waals layers with different electronic properties. We identify the CC layer as the high-gap region responsible for the main STM peak. Remarkably, this region belongs to the same Fermi surface sheet that is broken by the CDW gap opening. Simulations reveal a highly anisotropic distribution of the superconducting gap within single Fermi sheets, setting aside the proposed scenario of a two-gap superconductivity. Our results point to a spatially localized competition between superconductivity and CDW involving the HC regions of the crystal.

Highlights

  • We present clear evidence of anisotropic superconductivity in NbSe2 by measuring the tunneling density of states (DOS) with unprecedented resolution combined with state-of-the-art first-principles simulations of the superconducting state based on density functional theory for superconductors (SCDFT)

  • Besides the atomic corrugation of the terminating Se layer, the image reveals the modulation of the local DOS imposed by the CDW

  • The improved SCDFT estimacuts on the Nb planes of L1 and L2

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Summary

Introduction

Collective phenomena such as superconductivity and charge- or spin-density modulations have been found to co-exist in many materials, the interplay among these correlations being discussed in terms of their competition or mutual enhancement[1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22]. The layered transition-metal dichalcogenide 2H-NbSe2 is a prominent example undergoing a transition into a chargeordered phase at T ≤33 K, and into the superconducting phase at Tc ≤ 7.2 K. Both orderings are driven by electron-phonon coupling[23,24,25,26,27,28,29,30,31] with a strong momentum dependence[14,17,20,32]. Accessing the momentum-dependent structure of the superconducting gap in the CDW phase would allow one to unveil the link between superconducting condensation and CDW ordering in this material, resolving the long-standing debate on their competition

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