Add getEfieldsNormalMode: fchk parsing, Kabsch alignment, normal mode…#124
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… projection New modules: - fchk_interface.py: parse geometry/modes from Gaussian or Q-Chem fchk files - normal_mode.py: Kabsch rotation, per-atom E-field, normal mode projection New method Electrostatics.getEfieldsNormalMode(): - Supports pure QM, QM/MM, and reuse of existing charge files - Gaussian fchk: auto-reads Vib-Modes and Vib-Freq - Q-Chem fchk: reads geometry only; user supplies mode vectors as array - Tested across all 6 conditions (QM, QM/MM, MM-only x bond + normal mode) Co-Authored-By: Claude Sonnet 4.6 <noreply@anthropic.com>
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… projection
New modules:
New method Electrostatics.getEfieldsNormalMode():
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