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Broken link in the webinar
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0
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55
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February 17, 2023
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How to obtain rpath
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4
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56
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February 17, 2023
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How to mix calculation methods for a big sized systems??
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3
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63
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February 16, 2023
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Possible error in the manual
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3
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61
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February 16, 2023
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How to solve IRC oscillation and obtain IRC figure with mass-weighted coordinates?
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8
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76
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February 14, 2023
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CCSD(T) calculations under big sized systems
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2
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74
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February 14, 2023
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EOM-CCSD NDO outut
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3
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222
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February 13, 2023
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Failed H2O simulation - Beginner
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4
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74
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February 11, 2023
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How to obtain IRC figure
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3
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80
|
February 11, 2023
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Failed to read orbitals in a triplet PP calculation
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2
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115
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February 10, 2023
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Transition state from from reactant and product structures Vfile?
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1
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57
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February 7, 2023
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Fixed carbon nanotube and optimize chain water
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3
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57
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February 6, 2023
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Change in energy in electric field is not what I would expect?
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2
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73
|
February 4, 2023
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System has a charge
|
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10
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121
|
February 3, 2023
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Is Nucleus-field progress useful to chemists?
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5
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134
|
February 1, 2023
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ASCI with SYMMETRY
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1
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56
|
January 30, 2023
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Asci / active size
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1
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83
|
January 30, 2023
|
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Crash reporter still active?
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2
|
57
|
January 30, 2023
|
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Spin-flip EOM discontinuities
|
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2
|
86
|
January 19, 2023
|
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Could not open driver file in ReadDriverFromDisk
|
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1
|
86
|
January 18, 2023
|
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Transition Dipole Moments for SA-SF-DFT
|
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2
|
87
|
January 17, 2023
|
|
Dummy atom and pes_scan
|
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5
|
84
|
January 14, 2023
|
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Stand-alone QM/MM using CHARMM parameters
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3
|
63
|
January 13, 2023
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RASCI calcualtion will crash with large active space, is it possible to solve?
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1
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59
|
January 12, 2023
|
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What's the meaning of Colinear Bend Constraint
|
|
10
|
91
|
January 10, 2023
|
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Frequency calculation not completing
|
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3
|
102
|
January 7, 2023
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Seam ponit only
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1
|
68
|
December 29, 2022
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Optimization problem in mecp
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1
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69
|
December 25, 2022
|
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Plotting electrostatic potentials
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|
5
|
99
|
December 23, 2022
|
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Negative frequency in excited state TDDFT calculation
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4
|
88
|
December 22, 2022
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