검색결과 : 19건
| No. | Article |
|---|---|
| 1 |
Adsorption and Diffusion of N-2 and CO2 and Their Mixture on Silica Gel Goyal P, Purdue MJ, Farooq S Industrial & Engineering Chemistry Research, 58(42), 19611, 2019 |
| 2 |
Effect of interface in dielectric relaxation properties of PEMA-BaZrO3 nanocomposites Singh PK, Goyal P, Sharma A, Rajesh, Kaur D, Gaur MS Polymer Bulletin, 75(9), 4003, 2018 |
| 3 |
POD-DEIM for efficient reduction of a dynamic 2D catalytic reactor model Bremer J, Goyal P, Feng L, Benner P, Sundmacher K Computers & Chemical Engineering, 106, 777, 2017 |
| 4 |
Effect of Protonation upon Electronic Coupling in the Mixed Valence and Mixed Protonated Complex, [Ni(2,3-pyrazinedithiol)(2)] Kennedy SR, Goyal P, Kozar MN, Yennawar HP, Hammes-Schiffer S, Lear BJ Inorganic Chemistry, 55(4), 1433, 2016 |
| 5 |
Copper Oxidation/Reduction in Water and Protein: Studies with DFTB3/MM and VALBOND Molecular Dynamics Simulations Jin HY, Goyal P, Das AK, Gaus M, Meuwly M, Cui Q Journal of Physical Chemistry B, 120(8), 1894, 2016 |
| 6 |
Proton Quantization and Vibrational Relaxation in Nonadiabatic Dynamics of Photoinduced Proton-Coupled Electron Transfer in a Solvated Phenol-Amine Complex Goyal P, Schwerdtfeger CA, Soudackov AV, Hammes-Schiffer S Journal of Physical Chemistry B, 120(9), 2407, 2016 |
| 7 |
Ultrasonic Assisted Transesterification of Neem Oil for Biodiesel Production Bahadur S, Goyal P, Sudhakar K Energy Sources Part A-recovery Utilization and Environmental Effects, 37(17), 1921, 2015 |
| 8 |
Nonadiabatic Dynamics of Photoinduced Proton-Coupled Electron Transfer in a Solvated Phenol-Amine Complex Goyal P, Schwerdtfeger CA, Soudackov AV, Hammes-Schiffer S Journal of Physical Chemistry B, 119(6), 2758, 2015 |
| 9 |
Role of the Active Site Guanine in the glmS Ribozyme Self-Cleavage Mechanism: Quantum Mechanical/Molecular Mechanical Free Energy Simulations Zhang SX, Ganguly A, Goyal P, Bingaman JL, Bevilacqua PC, Hammes-Schiffer S Journal of the American Chemical Society, 137(2), 784, 2015 |
| 10 |
Molecular Simulation of Water and Hydration Effects in Different Environments: Challenges and Developments for DFTB Based Models Goyal P, Qian HJ, Irle S, Lu XY, Roston D, Mori T, Elstner M, Cui Q Journal of Physical Chemistry B, 118(38), 11007, 2014 |