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341 results on '"Daniel Neuhauser"'

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101. Anharmonic Vibrations via Filter Diagonalization of ab Initio Dynamics Trajectories

102. Photodissociation of CH2. VI. Three-dimensional quantum dynamics of the dissociation through the coupled 2A″ and 3A″ states

103. Resonances from short time complex-scaled cross-correlation probability amplitudes by the filter-diagonalization method

104. Calculation of light distribution in optical devices by a global solution of an inhomogeneous scalar wave equation

105. Photoabsorption probability for a system governed by a time-dependent Hamiltonian through the (t,t′) formalism

106. Shifted-contour auxiliary-field Monte Carlo: circumventing the sign difficulty for electronic-structure calculations

107. Avoiding long propagation times in wave packet calculations on scattering with resonances: A new algorithm involving filter diagonalization

108. Self-averaging stochastic Kohn-Sham density functional theory

109. Scattering matrix elements by a time independent wave packet complex scaling formalism

110. Avoiding long propagation times in wave packet calculations on scattering with resonances: A hybrid approach involving the Lanczos method

111. Performance of a time‐independent scattering wave packet technique using real operators and wave functions

112. Application of generalized filter-diagonalization to extract instantaneous normal modes

113. Electron transfer beyond the static picture: a TDDFT∕TD-ZINDO study of a pentacene dimer

114. Molecular scattering: Very‐short‐range imaginary potentials, absorbing‐potentials, and flux‐amplitude expressions

115. Extraction, through filter‐diagonalization, of general quantum eigenvalues or classical normal mode frequencies from a small number of residues or a short‐time segment of a signal. I. Theory and application to a quantum‐dynamics model

116. Electronic structure via the auxiliary‐field Monte Carlo algorithm

117. Expeditious stochastic approach for MP2 energies in large electronic systems

118. Nanobelts

119. Nano-optical Biosensors

120. Nanostructures for surface functionalization and surface properties

121. Neural Activity-Dependent Closed-Loop

122. Nanoparticle Self-Assembly

123. Nanotransfer Printing

124. Nano-effects

125. Nanomaterials for Sensors

126. Nanotechnology in Cardiovascular Diseases

127. Nucleic Acid Amplification

128. Nanopatterned Substrata

129. Neural Interfaces

130. Nanostructure Field Effect Transistor Biosensors

131. Nanoscale Heat Transport

132. Near-Field Optics

133. Nano-optomechanical Systems (NOMS)

134. Nanostructured Antireflective Surfaces Arrays

135. Nonlinear Optical Absorption and Induced Thermal Scattering Studies in Organic and Inorganic Nanostructures

136. Nano-Tribology Applications in Microprojector Technology

137. Nanomaterials for Electrical Energy Storage Devices

138. Nanostructured Thermoelectrics

139. Nano-engineered Concrete

140. Nanostructures for Coloration (Organisms other than Animals)

141. Nanostructured Hydrogels

142. Nanoparticle Cytotoxicity

143. Nanorobotic Assembly

144. NEMS Gravimetric Chemical Sensors

145. Nanoscale Fluid Mechanics

146. Nanomaterials for Excitonic Solar Cells

147. Nanostructured Thermoelectric Materials

148. Nanorobotics for NEMS Using Helical Nanostructures

149. Nano-sized Nanocrystalline and Nano-twinned Metals

150. Nanomechanical Properties of Nanostructures

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