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MnO(001) thin films on MgO(001) grown by reactive MBE using supersonic molecular beams
American Institute of Physics | 2024| -
Exploring structure–property landscape of non-fullerene acceptors for organic solar cells
American Institute of Physics | 2024| -
Symmetry breaking and self-interaction correction in the chromium atom and dimer
American Institute of Physics | 2024| -
Time-dependent density functional theory with the orthogonal projector augmented wave method
American Institute of Physics | 2024| -
Structure and phase transitions in niobium and tantalum derived nanoscale transition metal perovskites, Ba(Ti,MV)O3, M=Nb,Ta
American Institute of Physics | 2024| -
Alkali hydroxide (LiOH, NaOH, KOH) in water: Structural and vibrational properties, including neutron scattering results
Free accessAmerican Institute of Physics | 2024| -
Modulation of supramolecular structure by stepwise removal of tert-butyl groups from tetraazaperopyrene derivatives on Ag(111)
American Institute of Physics | 2024| -
Phonon-mediated ultrafast energy- and momentum-resolved hole dynamics in monolayer black phosphorus
American Institute of Physics | 2024| -
Inverse design of pore wall chemistry and topology through active learning of surface group interactions
American Institute of Physics | 2024| -
Spatiotemporal evolution of ultrafast photocarrier dynamics across WS2–ReS2 lateral interface
American Institute of Physics | 2024| -
New physical insights into the supporting subspace factorization of XMS-CASPT2 and generalization to multiple spin states via spin-free formulation
American Institute of Physics | 2024| -
Footprints of loop extrusion in statistics of intra-chromosomal distances: An analytically solvable model
American Institute of Physics | 2024| -
Quantifying noise effects in optical measures of excited state transport
American Institute of Physics | 2024| -
CREST—A program for the exploration of low-energy molecular chemical space
Free accessAmerican Institute of Physics | 2024| -
Enhanced EMC—Advantages of partially known orientations in x-ray single particle imaging
Free accessAmerican Institute of Physics | 2024| -
Photofragmentation of cyclobutanone at 200 nm: TDDFT vs CASSCF electron diffraction
American Institute of Physics | 2024| -
Structure of liquid–vapor interfaces: Perspectives from liquid state theory, large-scale simulations, and potential grazing-incidence x-ray diffraction
Free accessAmerican Institute of Physics | 2024|
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